USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 886 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 THR OG1 : rot -170:sc= -0.0104 USER MOD Set 1.2: A 103 HIS : no HD1:sc= -0.254 X(o=-0.26,f=-0.51) USER MOD Set 2.1: A 42 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.00377 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.283 K(o=-0.28,f=-2.4!) USER MOD Single : A 11 GLN : amide:sc= -0.0035 X(o=-0.0035,f=-0.13) USER MOD Single : A 14 TYR OH : rot -11:sc= 0.153 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl -150:sc= -3.87! (180deg=-6.06!) USER MOD Single : A 24 THR OG1 : rot 178:sc= 0.22 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.086 USER MOD Single : A 27 CYS SG : rot 180:sc=-0.00903 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -170:sc= -0.0558 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0964 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.077) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= -0.0253 X(o=-0.025,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.186 K(o=-0.19,f=-2.2) USER MOD Single : A 54 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 HIS : no HD1:sc= -0.416 X(o=-0.42,f=-0.2) USER MOD Single : A 57 SER OG : rot 180:sc= -0.0349 USER MOD Single : A 59 ASN : amide:sc= -0.0936 X(o=-0.094,f=0) USER MOD Single : A 60 ASN : amide:sc= -1.04 K(o=-1,f=-4.3!) USER MOD Single : A 62 ASN : amide:sc= 0.3 K(o=0.3,f=-9.2!) USER MOD Single : A 65 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-3.4!) USER MOD Single : A 74 ASN : amide:sc= -0.535 K(o=-0.53,f=0) USER MOD Single : A 76 THR OG1 : rot 68:sc= 1.15 USER MOD Single : A 80 THR OG1 : rot 170:sc= -0.373 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -1.53 K(o=-1.5,f=-3!) USER MOD Single : A 93 THR OG1 : rot 63:sc= 0.2 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0661 USER MOD Single : A 98 GLN : amide:sc= -1.36 K(o=-1.4,f=-2.4!) USER MOD Single : A 108 GLN : amide:sc=-0.00492 X(o=-0.0049,f=-0.026) USER MOD Single : A 112 GLN : amide:sc= -0.106 K(o=-0.11,f=-1.3) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0.00482 USER MOD Single : A 117 SER OG : rot 72:sc= 0.6 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -25.073 -4.273 -25.804 1.00 0.00 N ATOM 2 CA GLY A 1 -25.115 -3.811 -24.429 1.00 0.00 C ATOM 3 C GLY A 1 -25.676 -4.855 -23.483 1.00 0.00 C ATOM 4 O GLY A 1 -25.390 -6.044 -23.620 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.183 -3.966 -26.246 1.00 0.00 H new ATOM 0 H2 GLY A 1 -25.129 -5.311 -25.823 1.00 0.00 H new ATOM 0 H3 GLY A 1 -25.877 -3.873 -26.329 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.109 -3.539 -24.110 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -25.723 -2.908 -24.371 1.00 0.00 H new ATOM 8 N SER A 2 -26.477 -4.409 -22.520 1.00 0.00 N ATOM 9 CA SER A 2 -27.076 -5.312 -21.545 1.00 0.00 C ATOM 10 C SER A 2 -28.459 -5.766 -22.001 1.00 0.00 C ATOM 11 O SER A 2 -29.477 -5.243 -21.549 1.00 0.00 O ATOM 12 CB SER A 2 -27.176 -4.629 -20.180 1.00 0.00 C ATOM 13 OG SER A 2 -25.974 -3.950 -19.860 1.00 0.00 O ATOM 0 H SER A 2 -26.726 -3.428 -22.395 1.00 0.00 H new ATOM 0 HA SER A 2 -26.435 -6.190 -21.459 1.00 0.00 H new ATOM 0 HB2 SER A 2 -28.006 -3.923 -20.183 1.00 0.00 H new ATOM 0 HB3 SER A 2 -27.393 -5.372 -19.413 1.00 0.00 H new ATOM 0 HG SER A 2 -26.064 -3.520 -18.984 1.00 0.00 H new ATOM 19 N SER A 3 -28.486 -6.744 -22.901 1.00 0.00 N ATOM 20 CA SER A 3 -29.743 -7.267 -23.424 1.00 0.00 C ATOM 21 C SER A 3 -30.531 -7.980 -22.329 1.00 0.00 C ATOM 22 O SER A 3 -31.749 -7.833 -22.229 1.00 0.00 O ATOM 23 CB SER A 3 -29.477 -8.228 -24.584 1.00 0.00 C ATOM 24 OG SER A 3 -30.506 -9.197 -24.690 1.00 0.00 O ATOM 0 H SER A 3 -27.652 -7.190 -23.283 1.00 0.00 H new ATOM 0 HA SER A 3 -30.335 -6.427 -23.786 1.00 0.00 H new ATOM 0 HB2 SER A 3 -29.404 -7.667 -25.516 1.00 0.00 H new ATOM 0 HB3 SER A 3 -28.519 -8.726 -24.436 1.00 0.00 H new ATOM 0 HG SER A 3 -30.313 -9.798 -25.440 1.00 0.00 H new ATOM 30 N GLY A 4 -29.827 -8.754 -21.509 1.00 0.00 N ATOM 31 CA GLY A 4 -30.476 -9.479 -20.433 1.00 0.00 C ATOM 32 C GLY A 4 -31.110 -8.556 -19.412 1.00 0.00 C ATOM 33 O GLY A 4 -30.648 -7.433 -19.209 1.00 0.00 O ATOM 0 H GLY A 4 -28.818 -8.892 -21.571 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -31.241 -10.134 -20.850 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -29.745 -10.117 -19.937 1.00 0.00 H new ATOM 37 N SER A 5 -32.173 -9.028 -18.769 1.00 0.00 N ATOM 38 CA SER A 5 -32.876 -8.234 -17.767 1.00 0.00 C ATOM 39 C SER A 5 -32.239 -8.409 -16.391 1.00 0.00 C ATOM 40 O SER A 5 -31.832 -9.509 -16.019 1.00 0.00 O ATOM 41 CB SER A 5 -34.352 -8.633 -17.713 1.00 0.00 C ATOM 42 OG SER A 5 -35.169 -7.649 -18.322 1.00 0.00 O ATOM 0 H SER A 5 -32.567 -9.956 -18.924 1.00 0.00 H new ATOM 0 HA SER A 5 -32.801 -7.185 -18.052 1.00 0.00 H new ATOM 0 HB2 SER A 5 -34.492 -9.589 -18.217 1.00 0.00 H new ATOM 0 HB3 SER A 5 -34.657 -8.772 -16.676 1.00 0.00 H new ATOM 0 HG SER A 5 -36.107 -7.929 -18.276 1.00 0.00 H new ATOM 48 N SER A 6 -32.158 -7.315 -15.641 1.00 0.00 N ATOM 49 CA SER A 6 -31.568 -7.344 -14.308 1.00 0.00 C ATOM 50 C SER A 6 -32.390 -8.224 -13.370 1.00 0.00 C ATOM 51 O SER A 6 -31.862 -9.135 -12.734 1.00 0.00 O ATOM 52 CB SER A 6 -31.468 -5.927 -13.740 1.00 0.00 C ATOM 53 OG SER A 6 -30.298 -5.774 -12.955 1.00 0.00 O ATOM 0 H SER A 6 -32.494 -6.397 -15.934 1.00 0.00 H new ATOM 0 HA SER A 6 -30.566 -7.766 -14.390 1.00 0.00 H new ATOM 0 HB2 SER A 6 -31.459 -5.204 -14.556 1.00 0.00 H new ATOM 0 HB3 SER A 6 -32.348 -5.712 -13.133 1.00 0.00 H new ATOM 0 HG SER A 6 -30.256 -4.860 -12.605 1.00 0.00 H new ATOM 59 N GLY A 7 -33.686 -7.942 -13.289 1.00 0.00 N ATOM 60 CA GLY A 7 -34.561 -8.715 -12.426 1.00 0.00 C ATOM 61 C GLY A 7 -34.321 -8.434 -10.956 1.00 0.00 C ATOM 62 O GLY A 7 -34.460 -7.298 -10.502 1.00 0.00 O ATOM 0 H GLY A 7 -34.146 -7.192 -13.805 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -35.599 -8.490 -12.671 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -34.411 -9.777 -12.619 1.00 0.00 H new ATOM 66 N VAL A 8 -33.961 -9.473 -10.208 1.00 0.00 N ATOM 67 CA VAL A 8 -33.702 -9.333 -8.780 1.00 0.00 C ATOM 68 C VAL A 8 -32.482 -10.146 -8.361 1.00 0.00 C ATOM 69 O VAL A 8 -32.393 -10.608 -7.225 1.00 0.00 O ATOM 70 CB VAL A 8 -34.915 -9.781 -7.943 1.00 0.00 C ATOM 71 CG1 VAL A 8 -36.073 -8.811 -8.120 1.00 0.00 C ATOM 72 CG2 VAL A 8 -35.331 -11.195 -8.322 1.00 0.00 C ATOM 0 H VAL A 8 -33.842 -10.420 -10.567 1.00 0.00 H new ATOM 0 HA VAL A 8 -33.512 -8.276 -8.595 1.00 0.00 H new ATOM 0 HB VAL A 8 -34.629 -9.780 -6.891 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -36.921 -9.144 -7.521 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -35.767 -7.816 -7.795 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -36.362 -8.777 -9.171 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -36.189 -11.495 -7.721 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -35.599 -11.225 -9.378 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -34.503 -11.879 -8.139 1.00 0.00 H new ATOM 82 N GLN A 9 -31.544 -10.314 -9.288 1.00 0.00 N ATOM 83 CA GLN A 9 -30.328 -11.071 -9.014 1.00 0.00 C ATOM 84 C GLN A 9 -29.178 -10.140 -8.645 1.00 0.00 C ATOM 85 O GLN A 9 -28.642 -9.431 -9.498 1.00 0.00 O ATOM 86 CB GLN A 9 -29.945 -11.918 -10.228 1.00 0.00 C ATOM 87 CG GLN A 9 -30.966 -12.992 -10.568 1.00 0.00 C ATOM 88 CD GLN A 9 -30.476 -14.388 -10.241 1.00 0.00 C ATOM 89 OE1 GLN A 9 -29.437 -14.560 -9.602 1.00 0.00 O ATOM 90 NE2 GLN A 9 -31.221 -15.396 -10.680 1.00 0.00 N ATOM 0 H GLN A 9 -31.603 -9.937 -10.234 1.00 0.00 H new ATOM 0 HA GLN A 9 -30.523 -11.729 -8.168 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -29.817 -11.264 -11.091 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -28.981 -12.391 -10.041 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -31.888 -12.797 -10.020 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -31.207 -12.935 -11.629 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -32.075 -15.208 -11.206 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -30.940 -16.358 -10.491 1.00 0.00 H new ATOM 99 N ASP A 10 -28.804 -10.146 -7.371 1.00 0.00 N ATOM 100 CA ASP A 10 -27.717 -9.301 -6.889 1.00 0.00 C ATOM 101 C ASP A 10 -27.288 -9.716 -5.485 1.00 0.00 C ATOM 102 O ASP A 10 -27.666 -10.782 -5.000 1.00 0.00 O ATOM 103 CB ASP A 10 -28.142 -7.833 -6.894 1.00 0.00 C ATOM 104 CG ASP A 10 -27.457 -7.034 -7.985 1.00 0.00 C ATOM 105 OD1 ASP A 10 -26.227 -7.179 -8.143 1.00 0.00 O ATOM 106 OD2 ASP A 10 -28.151 -6.265 -8.682 1.00 0.00 O ATOM 0 H ASP A 10 -29.237 -10.726 -6.653 1.00 0.00 H new ATOM 0 HA ASP A 10 -26.868 -9.426 -7.560 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -29.222 -7.771 -7.027 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -27.914 -7.389 -5.925 1.00 0.00 H new ATOM 111 N GLN A 11 -26.497 -8.865 -4.838 1.00 0.00 N ATOM 112 CA GLN A 11 -26.016 -9.145 -3.490 1.00 0.00 C ATOM 113 C GLN A 11 -25.058 -10.331 -3.489 1.00 0.00 C ATOM 114 O GLN A 11 -25.107 -11.181 -2.599 1.00 0.00 O ATOM 115 CB GLN A 11 -27.193 -9.423 -2.554 1.00 0.00 C ATOM 116 CG GLN A 11 -28.403 -8.541 -2.817 1.00 0.00 C ATOM 117 CD GLN A 11 -29.298 -8.399 -1.602 1.00 0.00 C ATOM 118 OE1 GLN A 11 -28.840 -8.032 -0.519 1.00 0.00 O ATOM 119 NE2 GLN A 11 -30.582 -8.689 -1.775 1.00 0.00 N ATOM 0 H GLN A 11 -26.176 -7.977 -5.225 1.00 0.00 H new ATOM 0 HA GLN A 11 -25.477 -8.267 -3.134 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -27.487 -10.468 -2.654 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -26.868 -9.281 -1.523 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -28.066 -7.554 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -28.980 -8.959 -3.642 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -30.918 -8.989 -2.690 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -31.232 -8.611 -0.993 1.00 0.00 H new ATOM 128 N LEU A 12 -24.188 -10.384 -4.491 1.00 0.00 N ATOM 129 CA LEU A 12 -23.218 -11.467 -4.606 1.00 0.00 C ATOM 130 C LEU A 12 -22.138 -11.347 -3.536 1.00 0.00 C ATOM 131 O LEU A 12 -21.870 -10.267 -3.008 1.00 0.00 O ATOM 132 CB LEU A 12 -22.578 -11.459 -5.996 1.00 0.00 C ATOM 133 CG LEU A 12 -22.207 -10.085 -6.556 1.00 0.00 C ATOM 134 CD1 LEU A 12 -21.665 -9.188 -5.455 1.00 0.00 C ATOM 135 CD2 LEU A 12 -21.192 -10.224 -7.681 1.00 0.00 C ATOM 0 H LEU A 12 -24.134 -9.689 -5.236 1.00 0.00 H new ATOM 0 HA LEU A 12 -23.744 -12.410 -4.460 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -21.677 -12.071 -5.963 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -23.264 -11.940 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 12 -23.108 -9.624 -6.961 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.407 -8.215 -5.873 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -22.423 -9.061 -4.682 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -20.776 -9.644 -5.019 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -20.940 -9.237 -8.067 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -20.291 -10.706 -7.301 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -21.617 -10.829 -8.482 1.00 0.00 H new ATOM 147 N PRO A 13 -21.501 -12.481 -3.207 1.00 0.00 N ATOM 148 CA PRO A 13 -20.439 -12.528 -2.199 1.00 0.00 C ATOM 149 C PRO A 13 -19.165 -11.833 -2.666 1.00 0.00 C ATOM 150 O PRO A 13 -19.087 -11.352 -3.797 1.00 0.00 O ATOM 151 CB PRO A 13 -20.192 -14.028 -2.014 1.00 0.00 C ATOM 152 CG PRO A 13 -20.627 -14.644 -3.298 1.00 0.00 C ATOM 153 CD PRO A 13 -21.770 -13.804 -3.796 1.00 0.00 C ATOM 0 HA PRO A 13 -20.724 -12.012 -1.282 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -19.141 -14.234 -1.812 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -20.762 -14.422 -1.173 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -19.810 -14.659 -4.020 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -20.939 -15.678 -3.149 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.794 -13.762 -4.885 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -22.732 -14.201 -3.471 1.00 0.00 H new ATOM 161 N TYR A 14 -18.168 -11.783 -1.790 1.00 0.00 N ATOM 162 CA TYR A 14 -16.898 -11.145 -2.112 1.00 0.00 C ATOM 163 C TYR A 14 -17.092 -9.658 -2.396 1.00 0.00 C ATOM 164 O TYR A 14 -17.964 -9.271 -3.173 1.00 0.00 O ATOM 165 CB TYR A 14 -16.253 -11.825 -3.321 1.00 0.00 C ATOM 166 CG TYR A 14 -14.749 -11.943 -3.218 1.00 0.00 C ATOM 167 CD1 TYR A 14 -14.145 -12.382 -2.046 1.00 0.00 C ATOM 168 CD2 TYR A 14 -13.931 -11.615 -4.293 1.00 0.00 C ATOM 169 CE1 TYR A 14 -12.772 -12.491 -1.947 1.00 0.00 C ATOM 170 CE2 TYR A 14 -12.557 -11.723 -4.204 1.00 0.00 C ATOM 171 CZ TYR A 14 -11.982 -12.161 -3.029 1.00 0.00 C ATOM 172 OH TYR A 14 -10.613 -12.267 -2.936 1.00 0.00 O ATOM 0 H TYR A 14 -18.215 -12.177 -0.850 1.00 0.00 H new ATOM 0 HA TYR A 14 -16.239 -11.250 -1.250 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -16.680 -12.821 -3.438 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -16.504 -11.263 -4.220 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -14.760 -12.643 -1.198 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -14.378 -11.270 -5.214 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.319 -12.833 -1.028 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -11.936 -11.466 -5.050 1.00 0.00 H new ATOM 0 HH TYR A 14 -10.359 -12.415 -2.001 1.00 0.00 H new ATOM 182 N SER A 15 -16.270 -8.829 -1.759 1.00 0.00 N ATOM 183 CA SER A 15 -16.352 -7.384 -1.939 1.00 0.00 C ATOM 184 C SER A 15 -14.989 -6.804 -2.304 1.00 0.00 C ATOM 185 O SER A 15 -13.950 -7.364 -1.956 1.00 0.00 O ATOM 186 CB SER A 15 -16.877 -6.719 -0.665 1.00 0.00 C ATOM 187 OG SER A 15 -18.083 -6.019 -0.915 1.00 0.00 O ATOM 0 H SER A 15 -15.540 -9.133 -1.114 1.00 0.00 H new ATOM 0 HA SER A 15 -17.044 -7.183 -2.757 1.00 0.00 H new ATOM 0 HB2 SER A 15 -17.044 -7.476 0.101 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.127 -6.030 -0.275 1.00 0.00 H new ATOM 0 HG SER A 15 -18.399 -5.605 -0.085 1.00 0.00 H new ATOM 193 N VAL A 16 -15.002 -5.677 -3.010 1.00 0.00 N ATOM 194 CA VAL A 16 -13.769 -5.019 -3.422 1.00 0.00 C ATOM 195 C VAL A 16 -13.745 -3.563 -2.971 1.00 0.00 C ATOM 196 O VAL A 16 -14.782 -2.985 -2.644 1.00 0.00 O ATOM 197 CB VAL A 16 -13.587 -5.075 -4.951 1.00 0.00 C ATOM 198 CG1 VAL A 16 -12.210 -4.563 -5.344 1.00 0.00 C ATOM 199 CG2 VAL A 16 -13.805 -6.490 -5.462 1.00 0.00 C ATOM 0 H VAL A 16 -15.854 -5.201 -3.308 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.949 -5.557 -2.946 1.00 0.00 H new ATOM 0 HB VAL A 16 -14.334 -4.428 -5.412 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -12.100 -4.610 -6.427 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -12.097 -3.531 -5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -11.444 -5.181 -4.874 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -13.672 -6.511 -6.544 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -13.084 -7.161 -4.995 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -14.816 -6.815 -5.214 1.00 0.00 H new ATOM 209 N THR A 17 -12.553 -2.974 -2.955 1.00 0.00 N ATOM 210 CA THR A 17 -12.393 -1.585 -2.543 1.00 0.00 C ATOM 211 C THR A 17 -11.248 -0.917 -3.296 1.00 0.00 C ATOM 212 O THR A 17 -10.140 -1.451 -3.363 1.00 0.00 O ATOM 213 CB THR A 17 -12.131 -1.475 -1.030 1.00 0.00 C ATOM 214 OG1 THR A 17 -13.181 -2.122 -0.302 1.00 0.00 O ATOM 215 CG2 THR A 17 -12.034 -0.018 -0.602 1.00 0.00 C ATOM 0 H THR A 17 -11.685 -3.437 -3.223 1.00 0.00 H new ATOM 0 HA THR A 17 -13.327 -1.075 -2.780 1.00 0.00 H new ATOM 0 HB THR A 17 -11.182 -1.966 -0.812 1.00 0.00 H new ATOM 0 HG1 THR A 17 -13.094 -1.914 0.652 1.00 0.00 H new ATOM 0 HG21 THR A 17 -11.849 0.034 0.471 1.00 0.00 H new ATOM 0 HG22 THR A 17 -11.215 0.464 -1.136 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.969 0.492 -0.834 1.00 0.00 H new ATOM 223 N LEU A 18 -11.521 0.254 -3.861 1.00 0.00 N ATOM 224 CA LEU A 18 -10.513 0.997 -4.609 1.00 0.00 C ATOM 225 C LEU A 18 -10.369 2.416 -4.068 1.00 0.00 C ATOM 226 O LEU A 18 -11.349 3.033 -3.650 1.00 0.00 O ATOM 227 CB LEU A 18 -10.878 1.039 -6.093 1.00 0.00 C ATOM 228 CG LEU A 18 -9.777 1.512 -7.043 1.00 0.00 C ATOM 229 CD1 LEU A 18 -9.516 2.999 -6.858 1.00 0.00 C ATOM 230 CD2 LEU A 18 -8.502 0.713 -6.821 1.00 0.00 C ATOM 0 H LEU A 18 -12.432 0.710 -3.815 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.558 0.485 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -11.189 0.040 -6.398 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.741 1.693 -6.216 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.111 1.347 -8.067 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.730 3.318 -7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.428 3.557 -7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -9.203 3.188 -5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.729 1.063 -7.506 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.164 0.846 -5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.698 -0.343 -7.005 1.00 0.00 H new ATOM 242 N ILE A 19 -9.143 2.927 -4.082 1.00 0.00 N ATOM 243 CA ILE A 19 -8.872 4.275 -3.597 1.00 0.00 C ATOM 244 C ILE A 19 -7.927 5.018 -4.535 1.00 0.00 C ATOM 245 O ILE A 19 -7.002 4.430 -5.094 1.00 0.00 O ATOM 246 CB ILE A 19 -8.261 4.252 -2.183 1.00 0.00 C ATOM 247 CG1 ILE A 19 -7.269 3.094 -2.052 1.00 0.00 C ATOM 248 CG2 ILE A 19 -9.357 4.139 -1.134 1.00 0.00 C ATOM 249 CD1 ILE A 19 -7.800 1.933 -1.240 1.00 0.00 C ATOM 0 H ILE A 19 -8.321 2.428 -4.424 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.829 4.796 -3.562 1.00 0.00 H new ATOM 0 HB ILE A 19 -7.724 5.186 -2.020 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -7.003 2.739 -3.048 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.353 3.461 -1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.909 4.124 -0.140 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -10.029 4.993 -1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -9.919 3.219 -1.293 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.044 1.149 -1.189 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.039 2.273 -0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.700 1.539 -1.713 1.00 0.00 H new ATOM 261 N SER A 20 -8.166 6.315 -4.701 1.00 0.00 N ATOM 262 CA SER A 20 -7.338 7.139 -5.573 1.00 0.00 C ATOM 263 C SER A 20 -7.046 8.491 -4.928 1.00 0.00 C ATOM 264 O SER A 20 -7.854 9.415 -5.006 1.00 0.00 O ATOM 265 CB SER A 20 -8.028 7.344 -6.923 1.00 0.00 C ATOM 266 OG SER A 20 -7.224 8.121 -7.794 1.00 0.00 O ATOM 0 H SER A 20 -8.926 6.818 -4.243 1.00 0.00 H new ATOM 0 HA SER A 20 -6.393 6.620 -5.731 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.234 6.376 -7.380 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.988 7.837 -6.773 1.00 0.00 H new ATOM 0 HG SER A 20 -7.686 8.236 -8.650 1.00 0.00 H new ATOM 272 N MET A 21 -5.885 8.596 -4.289 1.00 0.00 N ATOM 273 CA MET A 21 -5.486 9.834 -3.630 1.00 0.00 C ATOM 274 C MET A 21 -4.209 10.393 -4.251 1.00 0.00 C ATOM 275 O MET A 21 -3.309 9.653 -4.650 1.00 0.00 O ATOM 276 CB MET A 21 -5.278 9.597 -2.133 1.00 0.00 C ATOM 277 CG MET A 21 -5.560 8.167 -1.700 1.00 0.00 C ATOM 278 SD MET A 21 -4.227 7.034 -2.136 1.00 0.00 S ATOM 279 CE MET A 21 -4.368 5.824 -0.822 1.00 0.00 C ATOM 0 H MET A 21 -5.205 7.839 -4.214 1.00 0.00 H new ATOM 0 HA MET A 21 -6.285 10.563 -3.767 1.00 0.00 H new ATOM 0 HB2 MET A 21 -4.251 9.851 -1.872 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.925 10.272 -1.573 1.00 0.00 H new ATOM 0 HG2 MET A 21 -5.715 8.142 -0.621 1.00 0.00 H new ATOM 0 HG3 MET A 21 -6.486 7.827 -2.163 1.00 0.00 H new ATOM 0 HE1 MET A 21 -3.387 5.398 -0.613 1.00 0.00 H new ATOM 0 HE2 MET A 21 -4.754 6.306 0.076 1.00 0.00 H new ATOM 0 HE3 MET A 21 -5.050 5.031 -1.129 1.00 0.00 H new ATOM 289 N PRO A 22 -4.127 11.729 -4.336 1.00 0.00 N ATOM 290 CA PRO A 22 -2.964 12.416 -4.906 1.00 0.00 C ATOM 291 C PRO A 22 -1.729 12.298 -4.021 1.00 0.00 C ATOM 292 O PRO A 22 -1.811 11.835 -2.883 1.00 0.00 O ATOM 293 CB PRO A 22 -3.421 13.874 -4.995 1.00 0.00 C ATOM 294 CG PRO A 22 -4.470 14.006 -3.945 1.00 0.00 C ATOM 295 CD PRO A 22 -5.162 12.672 -3.880 1.00 0.00 C ATOM 0 HA PRO A 22 -2.668 11.989 -5.864 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -2.593 14.560 -4.816 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -3.819 14.105 -5.983 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.028 14.264 -2.982 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.175 14.799 -4.195 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -5.498 12.442 -2.869 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -6.042 12.644 -4.522 1.00 0.00 H new ATOM 303 N ALA A 23 -0.584 12.719 -4.550 1.00 0.00 N ATOM 304 CA ALA A 23 0.668 12.662 -3.806 1.00 0.00 C ATOM 305 C ALA A 23 0.609 13.545 -2.564 1.00 0.00 C ATOM 306 O ALA A 23 -0.468 13.965 -2.138 1.00 0.00 O ATOM 307 CB ALA A 23 1.830 13.077 -4.696 1.00 0.00 C ATOM 0 H ALA A 23 -0.498 13.103 -5.491 1.00 0.00 H new ATOM 0 HA ALA A 23 0.823 11.633 -3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.759 13.030 -4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.893 12.403 -5.550 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.672 14.096 -5.049 1.00 0.00 H new ATOM 313 N THR A 24 1.773 13.824 -1.985 1.00 0.00 N ATOM 314 CA THR A 24 1.853 14.655 -0.791 1.00 0.00 C ATOM 315 C THR A 24 3.202 15.360 -0.702 1.00 0.00 C ATOM 316 O THR A 24 4.250 14.750 -0.918 1.00 0.00 O ATOM 317 CB THR A 24 1.636 13.824 0.488 1.00 0.00 C ATOM 318 OG1 THR A 24 2.889 13.315 0.960 1.00 0.00 O ATOM 319 CG2 THR A 24 0.680 12.670 0.227 1.00 0.00 C ATOM 0 H THR A 24 2.674 13.486 -2.324 1.00 0.00 H new ATOM 0 HA THR A 24 1.061 15.399 -0.870 1.00 0.00 H new ATOM 0 HB THR A 24 1.199 14.473 1.247 1.00 0.00 H new ATOM 0 HG1 THR A 24 2.747 12.816 1.791 1.00 0.00 H new ATOM 0 HG21 THR A 24 0.542 12.097 1.144 1.00 0.00 H new ATOM 0 HG22 THR A 24 -0.282 13.062 -0.104 1.00 0.00 H new ATOM 0 HG23 THR A 24 1.094 12.023 -0.546 1.00 0.00 H new ATOM 327 N THR A 25 3.170 16.650 -0.381 1.00 0.00 N ATOM 328 CA THR A 25 4.390 17.439 -0.264 1.00 0.00 C ATOM 329 C THR A 25 5.086 17.180 1.067 1.00 0.00 C ATOM 330 O THR A 25 4.538 16.515 1.945 1.00 0.00 O ATOM 331 CB THR A 25 4.099 18.946 -0.393 1.00 0.00 C ATOM 332 OG1 THR A 25 2.791 19.238 0.113 1.00 0.00 O ATOM 333 CG2 THR A 25 4.198 19.394 -1.844 1.00 0.00 C ATOM 0 H THR A 25 2.312 17.170 -0.197 1.00 0.00 H new ATOM 0 HA THR A 25 5.045 17.132 -1.080 1.00 0.00 H new ATOM 0 HB THR A 25 4.843 19.488 0.190 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.615 20.198 0.029 1.00 0.00 H new ATOM 0 HG21 THR A 25 3.989 20.462 -1.910 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.203 19.197 -2.218 1.00 0.00 H new ATOM 0 HG23 THR A 25 3.474 18.844 -2.445 1.00 0.00 H new ATOM 341 N GLU A 26 6.297 17.710 1.209 1.00 0.00 N ATOM 342 CA GLU A 26 7.068 17.535 2.434 1.00 0.00 C ATOM 343 C GLU A 26 7.302 16.054 2.723 1.00 0.00 C ATOM 344 O GLU A 26 7.564 15.667 3.862 1.00 0.00 O ATOM 345 CB GLU A 26 6.346 18.188 3.615 1.00 0.00 C ATOM 346 CG GLU A 26 6.279 19.703 3.524 1.00 0.00 C ATOM 347 CD GLU A 26 6.936 20.389 4.706 1.00 0.00 C ATOM 348 OE1 GLU A 26 7.066 19.745 5.768 1.00 0.00 O ATOM 349 OE2 GLU A 26 7.320 21.569 4.568 1.00 0.00 O ATOM 0 H GLU A 26 6.765 18.264 0.491 1.00 0.00 H new ATOM 0 HA GLU A 26 8.035 18.018 2.296 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.333 17.791 3.675 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.853 17.910 4.539 1.00 0.00 H new ATOM 0 HG2 GLU A 26 6.764 20.030 2.604 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.236 20.014 3.462 1.00 0.00 H new ATOM 356 N CYS A 27 7.203 15.232 1.684 1.00 0.00 N ATOM 357 CA CYS A 27 7.402 13.794 1.826 1.00 0.00 C ATOM 358 C CYS A 27 6.477 13.220 2.893 1.00 0.00 C ATOM 359 O CYS A 27 5.547 13.887 3.347 1.00 0.00 O ATOM 360 CB CYS A 27 8.859 13.492 2.180 1.00 0.00 C ATOM 361 SG CYS A 27 10.060 14.528 1.312 1.00 0.00 S ATOM 0 H CYS A 27 6.986 15.536 0.735 1.00 0.00 H new ATOM 0 HA CYS A 27 7.163 13.323 0.873 1.00 0.00 H new ATOM 0 HB2 CYS A 27 8.995 13.619 3.254 1.00 0.00 H new ATOM 0 HB3 CYS A 27 9.067 12.446 1.954 1.00 0.00 H new ATOM 0 HG CYS A 27 11.263 14.199 1.679 1.00 0.00 H new ATOM 367 N ARG A 28 6.737 11.978 3.288 1.00 0.00 N ATOM 368 CA ARG A 28 5.925 11.312 4.299 1.00 0.00 C ATOM 369 C ARG A 28 4.578 10.886 3.722 1.00 0.00 C ATOM 370 O ARG A 28 3.776 11.724 3.310 1.00 0.00 O ATOM 371 CB ARG A 28 5.709 12.236 5.499 1.00 0.00 C ATOM 372 CG ARG A 28 5.292 11.504 6.764 1.00 0.00 C ATOM 373 CD ARG A 28 5.913 12.132 8.002 1.00 0.00 C ATOM 374 NE ARG A 28 5.562 11.406 9.220 1.00 0.00 N ATOM 375 CZ ARG A 28 4.434 11.603 9.893 1.00 0.00 C ATOM 376 NH1 ARG A 28 3.552 12.498 9.470 1.00 0.00 N ATOM 377 NH2 ARG A 28 4.186 10.903 10.993 1.00 0.00 N ATOM 0 H ARG A 28 7.504 11.413 2.923 1.00 0.00 H new ATOM 0 HA ARG A 28 6.458 10.420 4.627 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.630 12.785 5.694 1.00 0.00 H new ATOM 0 HB3 ARG A 28 4.946 12.972 5.247 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.206 11.519 6.853 1.00 0.00 H new ATOM 0 HG3 ARG A 28 5.592 10.458 6.696 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.997 12.153 7.892 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.581 13.167 8.089 1.00 0.00 H new ATOM 0 HE ARG A 28 6.219 10.710 9.573 1.00 0.00 H new ATOM 0 HH11 ARG A 28 3.739 13.038 8.625 1.00 0.00 H new ATOM 0 HH12 ARG A 28 2.687 12.646 9.990 1.00 0.00 H new ATOM 0 HH21 ARG A 28 4.862 10.213 11.322 1.00 0.00 H new ATOM 0 HH22 ARG A 28 3.320 11.055 11.510 1.00 0.00 H new ATOM 391 N ARG A 29 4.338 9.580 3.696 1.00 0.00 N ATOM 392 CA ARG A 29 3.089 9.043 3.168 1.00 0.00 C ATOM 393 C ARG A 29 2.068 8.843 4.283 1.00 0.00 C ATOM 394 O ARG A 29 0.874 9.072 4.095 1.00 0.00 O ATOM 395 CB ARG A 29 3.343 7.716 2.450 1.00 0.00 C ATOM 396 CG ARG A 29 2.098 7.120 1.812 1.00 0.00 C ATOM 397 CD ARG A 29 1.762 7.809 0.499 1.00 0.00 C ATOM 398 NE ARG A 29 0.342 7.702 0.173 1.00 0.00 N ATOM 399 CZ ARG A 29 -0.284 8.523 -0.662 1.00 0.00 C ATOM 400 NH1 ARG A 29 0.380 9.507 -1.252 1.00 0.00 N ATOM 401 NH2 ARG A 29 -1.578 8.361 -0.908 1.00 0.00 N ATOM 0 H ARG A 29 4.991 8.874 4.034 1.00 0.00 H new ATOM 0 HA ARG A 29 2.686 9.763 2.456 1.00 0.00 H new ATOM 0 HB2 ARG A 29 4.098 7.869 1.679 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.754 7.000 3.162 1.00 0.00 H new ATOM 0 HG2 ARG A 29 2.252 6.055 1.637 1.00 0.00 H new ATOM 0 HG3 ARG A 29 1.256 7.212 2.498 1.00 0.00 H new ATOM 0 HD2 ARG A 29 2.042 8.861 0.559 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.353 7.368 -0.304 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.198 6.956 0.611 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.375 9.635 -1.065 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.104 10.136 -1.893 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -2.092 7.605 -0.455 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -2.058 8.992 -1.550 1.00 0.00 H new ATOM 415 N GLY A 30 2.547 8.414 5.447 1.00 0.00 N ATOM 416 CA GLY A 30 1.663 8.190 6.576 1.00 0.00 C ATOM 417 C GLY A 30 1.412 6.717 6.833 1.00 0.00 C ATOM 418 O GLY A 30 1.341 6.283 7.983 1.00 0.00 O ATOM 0 H GLY A 30 3.531 8.218 5.628 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.096 8.643 7.468 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.712 8.691 6.394 1.00 0.00 H new ATOM 422 N PHE A 31 1.275 5.946 5.759 1.00 0.00 N ATOM 423 CA PHE A 31 1.028 4.514 5.873 1.00 0.00 C ATOM 424 C PHE A 31 2.102 3.716 5.140 1.00 0.00 C ATOM 425 O PHE A 31 2.606 4.142 4.101 1.00 0.00 O ATOM 426 CB PHE A 31 -0.353 4.167 5.312 1.00 0.00 C ATOM 427 CG PHE A 31 -0.333 3.803 3.855 1.00 0.00 C ATOM 428 CD1 PHE A 31 0.123 2.561 3.443 1.00 0.00 C ATOM 429 CD2 PHE A 31 -0.771 4.703 2.896 1.00 0.00 C ATOM 430 CE1 PHE A 31 0.142 2.222 2.103 1.00 0.00 C ATOM 431 CE2 PHE A 31 -0.755 4.370 1.555 1.00 0.00 C ATOM 432 CZ PHE A 31 -0.297 3.129 1.158 1.00 0.00 C ATOM 0 H PHE A 31 1.331 6.289 4.800 1.00 0.00 H new ATOM 0 HA PHE A 31 1.061 4.248 6.930 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.769 3.335 5.881 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -1.020 5.017 5.457 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.468 1.849 4.178 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.129 5.675 3.200 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.499 1.250 1.796 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.100 5.080 0.818 1.00 0.00 H new ATOM 0 HZ PHE A 31 -0.282 2.868 0.110 1.00 0.00 H new ATOM 442 N SER A 32 2.448 2.556 5.690 1.00 0.00 N ATOM 443 CA SER A 32 3.466 1.700 5.092 1.00 0.00 C ATOM 444 C SER A 32 2.959 0.268 4.955 1.00 0.00 C ATOM 445 O SER A 32 1.979 -0.120 5.591 1.00 0.00 O ATOM 446 CB SER A 32 4.742 1.723 5.935 1.00 0.00 C ATOM 447 OG SER A 32 4.472 1.359 7.278 1.00 0.00 O ATOM 0 H SER A 32 2.038 2.188 6.548 1.00 0.00 H new ATOM 0 HA SER A 32 3.690 2.085 4.097 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.475 1.038 5.509 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.183 2.720 5.906 1.00 0.00 H new ATOM 0 HG SER A 32 5.304 1.380 7.796 1.00 0.00 H new ATOM 453 N VAL A 33 3.634 -0.515 4.119 1.00 0.00 N ATOM 454 CA VAL A 33 3.254 -1.905 3.898 1.00 0.00 C ATOM 455 C VAL A 33 4.417 -2.846 4.190 1.00 0.00 C ATOM 456 O VAL A 33 5.555 -2.409 4.364 1.00 0.00 O ATOM 457 CB VAL A 33 2.774 -2.133 2.452 1.00 0.00 C ATOM 458 CG1 VAL A 33 1.698 -1.124 2.081 1.00 0.00 C ATOM 459 CG2 VAL A 33 3.945 -2.057 1.485 1.00 0.00 C ATOM 0 H VAL A 33 4.447 -0.210 3.584 1.00 0.00 H new ATOM 0 HA VAL A 33 2.434 -2.121 4.583 1.00 0.00 H new ATOM 0 HB VAL A 33 2.340 -3.131 2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.371 -1.301 1.056 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.849 -1.232 2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.101 -0.115 2.164 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.588 -2.220 0.468 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.410 -1.073 1.553 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.678 -2.823 1.740 1.00 0.00 H new ATOM 469 N THR A 34 4.124 -4.142 4.243 1.00 0.00 N ATOM 470 CA THR A 34 5.145 -5.146 4.515 1.00 0.00 C ATOM 471 C THR A 34 5.175 -6.210 3.423 1.00 0.00 C ATOM 472 O THR A 34 4.158 -6.836 3.125 1.00 0.00 O ATOM 473 CB THR A 34 4.913 -5.829 5.875 1.00 0.00 C ATOM 474 OG1 THR A 34 5.378 -4.983 6.934 1.00 0.00 O ATOM 475 CG2 THR A 34 5.631 -7.169 5.938 1.00 0.00 C ATOM 0 H THR A 34 3.188 -4.521 4.101 1.00 0.00 H new ATOM 0 HA THR A 34 6.102 -4.625 4.537 1.00 0.00 H new ATOM 0 HB THR A 34 3.843 -6.002 5.991 1.00 0.00 H new ATOM 0 HG1 THR A 34 5.374 -5.482 7.777 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.452 -7.632 6.908 1.00 0.00 H new ATOM 0 HG22 THR A 34 5.255 -7.821 5.150 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.701 -7.015 5.801 1.00 0.00 H new ATOM 483 N VAL A 35 6.348 -6.410 2.830 1.00 0.00 N ATOM 484 CA VAL A 35 6.510 -7.401 1.773 1.00 0.00 C ATOM 485 C VAL A 35 7.341 -8.585 2.252 1.00 0.00 C ATOM 486 O VAL A 35 8.431 -8.411 2.796 1.00 0.00 O ATOM 487 CB VAL A 35 7.179 -6.788 0.528 1.00 0.00 C ATOM 488 CG1 VAL A 35 7.563 -7.877 -0.462 1.00 0.00 C ATOM 489 CG2 VAL A 35 6.260 -5.765 -0.121 1.00 0.00 C ATOM 0 H VAL A 35 7.199 -5.899 3.064 1.00 0.00 H new ATOM 0 HA VAL A 35 5.511 -7.747 1.507 1.00 0.00 H new ATOM 0 HB VAL A 35 8.090 -6.277 0.840 1.00 0.00 H new ATOM 0 HG11 VAL A 35 8.034 -7.425 -1.335 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.261 -8.568 0.010 1.00 0.00 H new ATOM 0 HG13 VAL A 35 6.669 -8.419 -0.772 1.00 0.00 H new ATOM 0 HG21 VAL A 35 6.749 -5.342 -0.999 1.00 0.00 H new ATOM 0 HG22 VAL A 35 5.331 -6.249 -0.421 1.00 0.00 H new ATOM 0 HG23 VAL A 35 6.041 -4.969 0.591 1.00 0.00 H new ATOM 499 N GLU A 36 6.819 -9.790 2.045 1.00 0.00 N ATOM 500 CA GLU A 36 7.514 -11.004 2.457 1.00 0.00 C ATOM 501 C GLU A 36 7.810 -11.896 1.255 1.00 0.00 C ATOM 502 O GLU A 36 6.897 -12.430 0.624 1.00 0.00 O ATOM 503 CB GLU A 36 6.679 -11.773 3.483 1.00 0.00 C ATOM 504 CG GLU A 36 7.117 -11.543 4.920 1.00 0.00 C ATOM 505 CD GLU A 36 6.666 -12.652 5.851 1.00 0.00 C ATOM 506 OE1 GLU A 36 5.441 -12.816 6.030 1.00 0.00 O ATOM 507 OE2 GLU A 36 7.539 -13.355 6.402 1.00 0.00 O ATOM 0 H GLU A 36 5.918 -9.951 1.595 1.00 0.00 H new ATOM 0 HA GLU A 36 8.460 -10.713 2.914 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.634 -11.482 3.380 1.00 0.00 H new ATOM 0 HB3 GLU A 36 6.737 -12.839 3.261 1.00 0.00 H new ATOM 0 HG2 GLU A 36 8.203 -11.462 4.956 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.715 -10.593 5.271 1.00 0.00 H new ATOM 514 N SER A 37 9.093 -12.052 0.943 1.00 0.00 N ATOM 515 CA SER A 37 9.510 -12.875 -0.186 1.00 0.00 C ATOM 516 C SER A 37 9.474 -14.356 0.178 1.00 0.00 C ATOM 517 O SER A 37 9.664 -14.726 1.336 1.00 0.00 O ATOM 518 CB SER A 37 10.919 -12.483 -0.637 1.00 0.00 C ATOM 519 OG SER A 37 11.876 -13.435 -0.204 1.00 0.00 O ATOM 0 H SER A 37 9.861 -11.619 1.456 1.00 0.00 H new ATOM 0 HA SER A 37 8.813 -12.704 -1.006 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.947 -12.402 -1.724 1.00 0.00 H new ATOM 0 HB3 SER A 37 11.172 -11.501 -0.238 1.00 0.00 H new ATOM 0 HG SER A 37 12.768 -13.163 -0.506 1.00 0.00 H new ATOM 525 N ALA A 38 9.228 -15.198 -0.819 1.00 0.00 N ATOM 526 CA ALA A 38 9.168 -16.639 -0.606 1.00 0.00 C ATOM 527 C ALA A 38 10.561 -17.258 -0.646 1.00 0.00 C ATOM 528 O ALA A 38 10.890 -18.124 0.165 1.00 0.00 O ATOM 529 CB ALA A 38 8.269 -17.290 -1.646 1.00 0.00 C ATOM 0 H ALA A 38 9.067 -14.907 -1.783 1.00 0.00 H new ATOM 0 HA ALA A 38 8.748 -16.818 0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 38 8.234 -18.366 -1.474 1.00 0.00 H new ATOM 0 HB2 ALA A 38 7.263 -16.877 -1.567 1.00 0.00 H new ATOM 0 HB3 ALA A 38 8.665 -17.094 -2.643 1.00 0.00 H new ATOM 535 N SER A 39 11.376 -16.809 -1.595 1.00 0.00 N ATOM 536 CA SER A 39 12.733 -17.322 -1.744 1.00 0.00 C ATOM 537 C SER A 39 13.423 -16.691 -2.949 1.00 0.00 C ATOM 538 O SER A 39 14.643 -16.521 -2.961 1.00 0.00 O ATOM 539 CB SER A 39 12.711 -18.845 -1.893 1.00 0.00 C ATOM 540 OG SER A 39 11.547 -19.273 -2.579 1.00 0.00 O ATOM 0 H SER A 39 11.120 -16.091 -2.273 1.00 0.00 H new ATOM 0 HA SER A 39 13.295 -17.060 -0.848 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.598 -19.173 -2.435 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.749 -19.311 -0.908 1.00 0.00 H new ATOM 0 HG SER A 39 11.557 -20.249 -2.663 1.00 0.00 H new ATOM 546 N SER A 40 12.635 -16.347 -3.962 1.00 0.00 N ATOM 547 CA SER A 40 13.169 -15.738 -5.174 1.00 0.00 C ATOM 548 C SER A 40 13.159 -14.216 -5.068 1.00 0.00 C ATOM 549 O SER A 40 12.970 -13.515 -6.061 1.00 0.00 O ATOM 550 CB SER A 40 12.358 -16.181 -6.393 1.00 0.00 C ATOM 551 OG SER A 40 12.844 -17.407 -6.911 1.00 0.00 O ATOM 0 H SER A 40 11.624 -16.480 -3.967 1.00 0.00 H new ATOM 0 HA SER A 40 14.201 -16.069 -5.293 1.00 0.00 H new ATOM 0 HB2 SER A 40 11.309 -16.290 -6.116 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.406 -15.412 -7.164 1.00 0.00 H new ATOM 0 HG SER A 40 12.308 -17.669 -7.688 1.00 0.00 H new ATOM 557 N ASN A 41 13.363 -13.712 -3.855 1.00 0.00 N ATOM 558 CA ASN A 41 13.377 -12.274 -3.618 1.00 0.00 C ATOM 559 C ASN A 41 12.313 -11.573 -4.457 1.00 0.00 C ATOM 560 O ASN A 41 12.516 -10.454 -4.928 1.00 0.00 O ATOM 561 CB ASN A 41 14.757 -11.696 -3.938 1.00 0.00 C ATOM 562 CG ASN A 41 15.680 -11.700 -2.734 1.00 0.00 C ATOM 563 OD1 ASN A 41 15.379 -11.094 -1.706 1.00 0.00 O ATOM 564 ND2 ASN A 41 16.810 -12.386 -2.858 1.00 0.00 N ATOM 0 H ASN A 41 13.521 -14.278 -3.022 1.00 0.00 H new ATOM 0 HA ASN A 41 13.154 -12.103 -2.565 1.00 0.00 H new ATOM 0 HB2 ASN A 41 15.212 -12.273 -4.743 1.00 0.00 H new ATOM 0 HB3 ASN A 41 14.644 -10.675 -4.303 1.00 0.00 H new ATOM 0 HD21 ASN A 41 17.470 -12.426 -2.082 1.00 0.00 H new ATOM 0 HD22 ASN A 41 17.018 -12.873 -3.730 1.00 0.00 H new ATOM 571 N TYR A 42 11.178 -12.239 -4.639 1.00 0.00 N ATOM 572 CA TYR A 42 10.082 -11.682 -5.423 1.00 0.00 C ATOM 573 C TYR A 42 8.836 -11.496 -4.562 1.00 0.00 C ATOM 574 O TYR A 42 8.356 -12.438 -3.933 1.00 0.00 O ATOM 575 CB TYR A 42 9.763 -12.592 -6.610 1.00 0.00 C ATOM 576 CG TYR A 42 8.565 -13.486 -6.384 1.00 0.00 C ATOM 577 CD1 TYR A 42 8.606 -14.510 -5.445 1.00 0.00 C ATOM 578 CD2 TYR A 42 7.393 -13.307 -7.108 1.00 0.00 C ATOM 579 CE1 TYR A 42 7.514 -15.330 -5.235 1.00 0.00 C ATOM 580 CE2 TYR A 42 6.296 -14.122 -6.903 1.00 0.00 C ATOM 581 CZ TYR A 42 6.362 -15.132 -5.967 1.00 0.00 C ATOM 582 OH TYR A 42 5.272 -15.946 -5.760 1.00 0.00 O ATOM 0 H TYR A 42 10.993 -13.165 -4.254 1.00 0.00 H new ATOM 0 HA TYR A 42 10.394 -10.706 -5.795 1.00 0.00 H new ATOM 0 HB2 TYR A 42 9.585 -11.976 -7.491 1.00 0.00 H new ATOM 0 HB3 TYR A 42 10.633 -13.212 -6.825 1.00 0.00 H new ATOM 0 HD1 TYR A 42 9.507 -14.667 -4.870 1.00 0.00 H new ATOM 0 HD2 TYR A 42 7.338 -12.518 -7.843 1.00 0.00 H new ATOM 0 HE1 TYR A 42 7.562 -16.122 -4.502 1.00 0.00 H new ATOM 0 HE2 TYR A 42 5.392 -13.969 -7.473 1.00 0.00 H new ATOM 0 HH TYR A 42 4.542 -15.673 -6.355 1.00 0.00 H new ATOM 592 N ALA A 43 8.319 -10.272 -4.540 1.00 0.00 N ATOM 593 CA ALA A 43 7.128 -9.960 -3.759 1.00 0.00 C ATOM 594 C ALA A 43 6.021 -10.977 -4.017 1.00 0.00 C ATOM 595 O ALA A 43 5.822 -11.421 -5.148 1.00 0.00 O ATOM 596 CB ALA A 43 6.640 -8.555 -4.077 1.00 0.00 C ATOM 0 H ALA A 43 8.706 -9.480 -5.054 1.00 0.00 H new ATOM 0 HA ALA A 43 7.394 -10.010 -2.703 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.750 -8.336 -3.486 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.422 -7.835 -3.835 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.398 -8.485 -5.137 1.00 0.00 H new ATOM 602 N THR A 44 5.302 -11.344 -2.960 1.00 0.00 N ATOM 603 CA THR A 44 4.216 -12.309 -3.072 1.00 0.00 C ATOM 604 C THR A 44 3.066 -11.954 -2.137 1.00 0.00 C ATOM 605 O THR A 44 1.895 -12.102 -2.492 1.00 0.00 O ATOM 606 CB THR A 44 4.699 -13.737 -2.752 1.00 0.00 C ATOM 607 OG1 THR A 44 3.584 -14.635 -2.715 1.00 0.00 O ATOM 608 CG2 THR A 44 5.432 -13.775 -1.420 1.00 0.00 C ATOM 0 H THR A 44 5.453 -10.987 -2.017 1.00 0.00 H new ATOM 0 HA THR A 44 3.867 -12.273 -4.104 1.00 0.00 H new ATOM 0 HB THR A 44 5.389 -14.048 -3.537 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.900 -15.540 -2.513 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.763 -14.793 -1.216 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.297 -13.113 -1.462 1.00 0.00 H new ATOM 0 HG23 THR A 44 4.762 -13.446 -0.626 1.00 0.00 H new ATOM 616 N THR A 45 3.404 -11.483 -0.941 1.00 0.00 N ATOM 617 CA THR A 45 2.399 -11.106 0.045 1.00 0.00 C ATOM 618 C THR A 45 2.601 -9.670 0.514 1.00 0.00 C ATOM 619 O THR A 45 3.731 -9.221 0.705 1.00 0.00 O ATOM 620 CB THR A 45 2.432 -12.043 1.267 1.00 0.00 C ATOM 621 OG1 THR A 45 1.849 -13.307 0.931 1.00 0.00 O ATOM 622 CG2 THR A 45 1.683 -11.429 2.440 1.00 0.00 C ATOM 0 H THR A 45 4.367 -11.353 -0.632 1.00 0.00 H new ATOM 0 HA THR A 45 1.428 -11.193 -0.444 1.00 0.00 H new ATOM 0 HB THR A 45 3.472 -12.189 1.557 1.00 0.00 H new ATOM 0 HG1 THR A 45 1.875 -13.898 1.713 1.00 0.00 H new ATOM 0 HG21 THR A 45 1.720 -12.109 3.291 1.00 0.00 H new ATOM 0 HG22 THR A 45 2.147 -10.481 2.712 1.00 0.00 H new ATOM 0 HG23 THR A 45 0.644 -11.256 2.158 1.00 0.00 H new ATOM 630 N VAL A 46 1.497 -8.953 0.699 1.00 0.00 N ATOM 631 CA VAL A 46 1.552 -7.567 1.149 1.00 0.00 C ATOM 632 C VAL A 46 0.504 -7.294 2.221 1.00 0.00 C ATOM 633 O VAL A 46 -0.642 -7.730 2.107 1.00 0.00 O ATOM 634 CB VAL A 46 1.340 -6.588 -0.022 1.00 0.00 C ATOM 635 CG1 VAL A 46 1.611 -5.159 0.421 1.00 0.00 C ATOM 636 CG2 VAL A 46 2.226 -6.967 -1.199 1.00 0.00 C ATOM 0 H VAL A 46 0.554 -9.309 0.544 1.00 0.00 H new ATOM 0 HA VAL A 46 2.546 -7.410 1.569 1.00 0.00 H new ATOM 0 HB VAL A 46 0.300 -6.652 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.456 -4.482 -0.419 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.931 -4.894 1.231 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.640 -5.075 0.770 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.064 -6.265 -2.017 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.272 -6.932 -0.893 1.00 0.00 H new ATOM 0 HG23 VAL A 46 1.978 -7.975 -1.531 1.00 0.00 H new ATOM 646 N GLN A 47 0.903 -6.570 3.261 1.00 0.00 N ATOM 647 CA GLN A 47 -0.003 -6.240 4.355 1.00 0.00 C ATOM 648 C GLN A 47 0.281 -4.842 4.894 1.00 0.00 C ATOM 649 O GLN A 47 1.437 -4.455 5.067 1.00 0.00 O ATOM 650 CB GLN A 47 0.124 -7.269 5.479 1.00 0.00 C ATOM 651 CG GLN A 47 -0.459 -8.628 5.129 1.00 0.00 C ATOM 652 CD GLN A 47 -0.187 -9.672 6.194 1.00 0.00 C ATOM 653 OE1 GLN A 47 -0.492 -9.469 7.370 1.00 0.00 O ATOM 654 NE2 GLN A 47 0.389 -10.797 5.788 1.00 0.00 N ATOM 0 H GLN A 47 1.848 -6.201 3.369 1.00 0.00 H new ATOM 0 HA GLN A 47 -1.022 -6.260 3.968 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.177 -7.389 5.733 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -0.376 -6.887 6.369 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -1.535 -8.532 4.987 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -0.041 -8.965 4.180 1.00 0.00 H new ATOM 0 HE21 GLN A 47 0.625 -10.923 4.804 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.596 -11.536 6.460 1.00 0.00 H new ATOM 663 N VAL A 48 -0.781 -4.087 5.157 1.00 0.00 N ATOM 664 CA VAL A 48 -0.645 -2.732 5.678 1.00 0.00 C ATOM 665 C VAL A 48 -0.188 -2.745 7.132 1.00 0.00 C ATOM 666 O VAL A 48 -0.925 -3.167 8.023 1.00 0.00 O ATOM 667 CB VAL A 48 -1.972 -1.956 5.576 1.00 0.00 C ATOM 668 CG1 VAL A 48 -1.766 -0.494 5.941 1.00 0.00 C ATOM 669 CG2 VAL A 48 -2.559 -2.087 4.178 1.00 0.00 C ATOM 0 H VAL A 48 -1.745 -4.391 5.018 1.00 0.00 H new ATOM 0 HA VAL A 48 0.108 -2.233 5.068 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.679 -2.386 6.285 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.714 0.038 5.863 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.393 -0.423 6.963 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.042 -0.047 5.259 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.496 -1.533 4.123 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.856 -1.684 3.449 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.746 -3.138 3.959 1.00 0.00 H new ATOM 679 N LYS A 49 1.034 -2.278 7.366 1.00 0.00 N ATOM 680 CA LYS A 49 1.592 -2.233 8.713 1.00 0.00 C ATOM 681 C LYS A 49 0.859 -1.207 9.571 1.00 0.00 C ATOM 682 O LYS A 49 0.225 -1.556 10.566 1.00 0.00 O ATOM 683 CB LYS A 49 3.084 -1.897 8.658 1.00 0.00 C ATOM 684 CG LYS A 49 3.855 -2.356 9.883 1.00 0.00 C ATOM 685 CD LYS A 49 5.286 -2.730 9.534 1.00 0.00 C ATOM 686 CE LYS A 49 6.182 -2.717 10.762 1.00 0.00 C ATOM 687 NZ LYS A 49 7.453 -1.982 10.514 1.00 0.00 N ATOM 0 H LYS A 49 1.657 -1.925 6.640 1.00 0.00 H new ATOM 0 HA LYS A 49 1.464 -3.216 9.166 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.519 -2.358 7.771 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.202 -0.819 8.548 1.00 0.00 H new ATOM 0 HG2 LYS A 49 3.857 -1.563 10.631 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.353 -3.214 10.330 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.304 -3.721 9.080 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.674 -2.033 8.792 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.651 -2.254 11.594 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.407 -3.742 11.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.036 -1.996 11.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.972 -2.439 9.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.240 -0.997 10.256 1.00 0.00 H new ATOM 701 N GLU A 50 0.951 0.060 9.177 1.00 0.00 N ATOM 702 CA GLU A 50 0.296 1.136 9.911 1.00 0.00 C ATOM 703 C GLU A 50 -0.266 2.184 8.955 1.00 0.00 C ATOM 704 O GLU A 50 0.279 2.411 7.875 1.00 0.00 O ATOM 705 CB GLU A 50 1.279 1.793 10.883 1.00 0.00 C ATOM 706 CG GLU A 50 1.823 0.841 11.935 1.00 0.00 C ATOM 707 CD GLU A 50 1.777 1.427 13.332 1.00 0.00 C ATOM 708 OE1 GLU A 50 2.291 2.549 13.523 1.00 0.00 O ATOM 709 OE2 GLU A 50 1.225 0.763 14.235 1.00 0.00 O ATOM 0 H GLU A 50 1.472 0.365 8.355 1.00 0.00 H new ATOM 0 HA GLU A 50 -0.530 0.704 10.476 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.112 2.210 10.317 1.00 0.00 H new ATOM 0 HB3 GLU A 50 0.783 2.626 11.381 1.00 0.00 H new ATOM 0 HG2 GLU A 50 1.248 -0.085 11.914 1.00 0.00 H new ATOM 0 HG3 GLU A 50 2.852 0.582 11.688 1.00 0.00 H new ATOM 716 N VAL A 51 -1.362 2.819 9.359 1.00 0.00 N ATOM 717 CA VAL A 51 -1.999 3.842 8.539 1.00 0.00 C ATOM 718 C VAL A 51 -2.211 5.127 9.332 1.00 0.00 C ATOM 719 O VAL A 51 -2.631 5.094 10.487 1.00 0.00 O ATOM 720 CB VAL A 51 -3.356 3.359 7.993 1.00 0.00 C ATOM 721 CG1 VAL A 51 -3.952 4.396 7.052 1.00 0.00 C ATOM 722 CG2 VAL A 51 -3.200 2.018 7.292 1.00 0.00 C ATOM 0 H VAL A 51 -1.827 2.643 10.250 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.329 4.040 7.702 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.040 3.228 8.831 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.910 4.038 6.676 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.100 5.333 7.590 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.273 4.561 6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -4.168 1.691 6.912 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.500 2.120 6.462 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.820 1.280 7.998 1.00 0.00 H new ATOM 732 N ASN A 52 -1.918 6.260 8.701 1.00 0.00 N ATOM 733 CA ASN A 52 -2.076 7.558 9.347 1.00 0.00 C ATOM 734 C ASN A 52 -3.220 8.345 8.714 1.00 0.00 C ATOM 735 O ASN A 52 -3.223 8.593 7.508 1.00 0.00 O ATOM 736 CB ASN A 52 -0.777 8.360 9.252 1.00 0.00 C ATOM 737 CG ASN A 52 -0.774 9.567 10.171 1.00 0.00 C ATOM 738 OD1 ASN A 52 -1.433 9.571 11.211 1.00 0.00 O ATOM 739 ND2 ASN A 52 -0.031 10.599 9.789 1.00 0.00 N ATOM 0 H ASN A 52 -1.570 6.305 7.743 1.00 0.00 H new ATOM 0 HA ASN A 52 -2.313 7.387 10.397 1.00 0.00 H new ATOM 0 HB2 ASN A 52 0.065 7.714 9.502 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -0.631 8.690 8.223 1.00 0.00 H new ATOM 0 HD21 ASN A 52 0.010 11.439 10.366 1.00 0.00 H new ATOM 0 HD22 ASN A 52 0.499 10.551 8.919 1.00 0.00 H new ATOM 746 N ARG A 53 -4.189 8.734 9.536 1.00 0.00 N ATOM 747 CA ARG A 53 -5.338 9.492 9.057 1.00 0.00 C ATOM 748 C ARG A 53 -5.038 10.988 9.047 1.00 0.00 C ATOM 749 O ARG A 53 -5.861 11.794 8.615 1.00 0.00 O ATOM 750 CB ARG A 53 -6.561 9.213 9.932 1.00 0.00 C ATOM 751 CG ARG A 53 -6.779 7.737 10.222 1.00 0.00 C ATOM 752 CD ARG A 53 -7.208 7.509 11.663 1.00 0.00 C ATOM 753 NE ARG A 53 -6.248 8.063 12.614 1.00 0.00 N ATOM 754 CZ ARG A 53 -6.462 8.124 13.923 1.00 0.00 C ATOM 755 NH1 ARG A 53 -7.598 7.668 14.435 1.00 0.00 N ATOM 756 NH2 ARG A 53 -5.540 8.642 14.725 1.00 0.00 N ATOM 0 H ARG A 53 -4.201 8.537 10.537 1.00 0.00 H new ATOM 0 HA ARG A 53 -5.550 9.175 8.036 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -6.452 9.748 10.876 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -7.448 9.613 9.440 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -7.539 7.341 9.548 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -5.859 7.187 10.024 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -8.185 7.964 11.827 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.321 6.440 11.843 1.00 0.00 H new ATOM 0 HE ARG A 53 -5.365 8.423 12.253 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -8.310 7.269 13.823 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.760 7.716 15.441 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -4.665 8.994 14.336 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -5.706 8.688 15.730 1.00 0.00 H new ATOM 770 N MET A 54 -3.853 11.351 9.527 1.00 0.00 N ATOM 771 CA MET A 54 -3.443 12.750 9.573 1.00 0.00 C ATOM 772 C MET A 54 -3.032 13.242 8.189 1.00 0.00 C ATOM 773 O MET A 54 -3.015 14.445 7.926 1.00 0.00 O ATOM 774 CB MET A 54 -2.286 12.933 10.556 1.00 0.00 C ATOM 775 CG MET A 54 -2.611 13.869 11.710 1.00 0.00 C ATOM 776 SD MET A 54 -1.137 14.606 12.442 1.00 0.00 S ATOM 777 CE MET A 54 -1.873 15.806 13.549 1.00 0.00 C ATOM 0 H MET A 54 -3.160 10.696 9.889 1.00 0.00 H new ATOM 0 HA MET A 54 -4.294 13.341 9.911 1.00 0.00 H new ATOM 0 HB2 MET A 54 -2.003 11.960 10.957 1.00 0.00 H new ATOM 0 HB3 MET A 54 -1.421 13.320 10.018 1.00 0.00 H new ATOM 0 HG2 MET A 54 -3.271 14.661 11.356 1.00 0.00 H new ATOM 0 HG3 MET A 54 -3.156 13.319 12.477 1.00 0.00 H new ATOM 0 HE1 MET A 54 -1.086 16.345 14.076 1.00 0.00 H new ATOM 0 HE2 MET A 54 -2.473 16.511 12.974 1.00 0.00 H new ATOM 0 HE3 MET A 54 -2.508 15.293 14.271 1.00 0.00 H new ATOM 787 N HIS A 55 -2.700 12.304 7.307 1.00 0.00 N ATOM 788 CA HIS A 55 -2.289 12.643 5.949 1.00 0.00 C ATOM 789 C HIS A 55 -3.263 12.065 4.926 1.00 0.00 C ATOM 790 O HIS A 55 -3.161 12.345 3.732 1.00 0.00 O ATOM 791 CB HIS A 55 -0.877 12.123 5.676 1.00 0.00 C ATOM 792 CG HIS A 55 0.160 13.202 5.630 1.00 0.00 C ATOM 793 ND1 HIS A 55 1.511 12.954 5.758 1.00 0.00 N ATOM 794 CD2 HIS A 55 0.039 14.540 5.468 1.00 0.00 C ATOM 795 CE1 HIS A 55 2.175 14.093 5.678 1.00 0.00 C ATOM 796 NE2 HIS A 55 1.305 15.071 5.501 1.00 0.00 N ATOM 0 H HIS A 55 -2.708 11.304 7.508 1.00 0.00 H new ATOM 0 HA HIS A 55 -2.293 13.729 5.855 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.607 11.404 6.450 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -0.873 11.586 4.727 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.882 15.088 5.337 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.247 14.206 5.746 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.536 16.060 5.405 1.00 0.00 H new ATOM 805 N ILE A 56 -4.204 11.258 5.403 1.00 0.00 N ATOM 806 CA ILE A 56 -5.196 10.642 4.531 1.00 0.00 C ATOM 807 C ILE A 56 -6.608 11.075 4.911 1.00 0.00 C ATOM 808 O ILE A 56 -7.040 10.887 6.048 1.00 0.00 O ATOM 809 CB ILE A 56 -5.111 9.105 4.580 1.00 0.00 C ATOM 810 CG1 ILE A 56 -3.710 8.636 4.183 1.00 0.00 C ATOM 811 CG2 ILE A 56 -6.160 8.487 3.667 1.00 0.00 C ATOM 812 CD1 ILE A 56 -3.506 7.145 4.334 1.00 0.00 C ATOM 0 H ILE A 56 -4.300 11.015 6.389 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.977 10.978 3.517 1.00 0.00 H new ATOM 0 HB ILE A 56 -5.307 8.778 5.601 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -3.522 8.917 3.147 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -2.974 9.159 4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.087 7.400 3.712 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.153 8.798 3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.992 8.819 2.643 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.491 6.885 4.035 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -3.662 6.860 5.374 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.218 6.614 3.702 1.00 0.00 H new ATOM 824 N SER A 57 -7.322 11.653 3.951 1.00 0.00 N ATOM 825 CA SER A 57 -8.685 12.114 4.185 1.00 0.00 C ATOM 826 C SER A 57 -9.578 10.963 4.640 1.00 0.00 C ATOM 827 O SER A 57 -9.232 9.788 4.514 1.00 0.00 O ATOM 828 CB SER A 57 -9.258 12.747 2.915 1.00 0.00 C ATOM 829 OG SER A 57 -9.289 14.160 3.019 1.00 0.00 O ATOM 0 H SER A 57 -6.979 11.813 3.004 1.00 0.00 H new ATOM 0 HA SER A 57 -8.657 12.864 4.976 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.654 12.456 2.055 1.00 0.00 H new ATOM 0 HB3 SER A 57 -10.266 12.370 2.740 1.00 0.00 H new ATOM 0 HG SER A 57 -9.657 14.541 2.195 1.00 0.00 H new ATOM 835 N PRO A 58 -10.755 11.307 5.183 1.00 0.00 N ATOM 836 CA PRO A 58 -11.723 10.319 5.667 1.00 0.00 C ATOM 837 C PRO A 58 -12.366 9.531 4.531 1.00 0.00 C ATOM 838 O PRO A 58 -12.768 8.382 4.709 1.00 0.00 O ATOM 839 CB PRO A 58 -12.771 11.171 6.387 1.00 0.00 C ATOM 840 CG PRO A 58 -12.677 12.511 5.742 1.00 0.00 C ATOM 841 CD PRO A 58 -11.232 12.689 5.364 1.00 0.00 C ATOM 0 HA PRO A 58 -11.254 9.568 6.303 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -13.769 10.748 6.277 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -12.566 11.231 7.456 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -13.320 12.567 4.864 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -13.001 13.296 6.425 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -11.125 13.274 4.451 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -10.674 13.208 6.143 1.00 0.00 H new ATOM 849 N ASN A 59 -12.459 10.157 3.362 1.00 0.00 N ATOM 850 CA ASN A 59 -13.053 9.514 2.196 1.00 0.00 C ATOM 851 C ASN A 59 -12.169 8.379 1.691 1.00 0.00 C ATOM 852 O ASN A 59 -12.570 7.605 0.823 1.00 0.00 O ATOM 853 CB ASN A 59 -13.275 10.538 1.081 1.00 0.00 C ATOM 854 CG ASN A 59 -14.694 10.515 0.548 1.00 0.00 C ATOM 855 OD1 ASN A 59 -14.919 10.290 -0.641 1.00 0.00 O ATOM 856 ND2 ASN A 59 -15.661 10.748 1.429 1.00 0.00 N ATOM 0 H ASN A 59 -12.131 11.109 3.197 1.00 0.00 H new ATOM 0 HA ASN A 59 -14.015 9.096 2.493 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -13.047 11.535 1.457 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -12.580 10.339 0.265 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -16.636 10.745 1.129 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -15.428 10.930 2.405 1.00 0.00 H new ATOM 863 N ASN A 60 -10.963 8.286 2.241 1.00 0.00 N ATOM 864 CA ASN A 60 -10.021 7.245 1.847 1.00 0.00 C ATOM 865 C ASN A 60 -9.654 6.363 3.037 1.00 0.00 C ATOM 866 O ASN A 60 -9.230 5.219 2.867 1.00 0.00 O ATOM 867 CB ASN A 60 -8.757 7.870 1.253 1.00 0.00 C ATOM 868 CG ASN A 60 -9.058 9.094 0.410 1.00 0.00 C ATOM 869 OD1 ASN A 60 -10.167 9.252 -0.100 1.00 0.00 O ATOM 870 ND2 ASN A 60 -8.069 9.967 0.260 1.00 0.00 N ATOM 0 H ASN A 60 -10.615 8.919 2.961 1.00 0.00 H new ATOM 0 HA ASN A 60 -10.501 6.623 1.091 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -8.078 8.146 2.060 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.241 7.129 0.642 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.213 10.810 -0.296 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.166 9.795 0.701 1.00 0.00 H new ATOM 877 N ARG A 61 -9.823 6.902 4.240 1.00 0.00 N ATOM 878 CA ARG A 61 -9.510 6.164 5.458 1.00 0.00 C ATOM 879 C ARG A 61 -10.550 5.080 5.720 1.00 0.00 C ATOM 880 O ARG A 61 -10.399 4.268 6.631 1.00 0.00 O ATOM 881 CB ARG A 61 -9.439 7.118 6.652 1.00 0.00 C ATOM 882 CG ARG A 61 -10.693 7.112 7.511 1.00 0.00 C ATOM 883 CD ARG A 61 -10.647 8.201 8.571 1.00 0.00 C ATOM 884 NE ARG A 61 -10.847 7.665 9.915 1.00 0.00 N ATOM 885 CZ ARG A 61 -12.012 7.203 10.356 1.00 0.00 C ATOM 886 NH1 ARG A 61 -13.075 7.212 9.564 1.00 0.00 N ATOM 887 NH2 ARG A 61 -12.115 6.732 11.592 1.00 0.00 N ATOM 0 H ARG A 61 -10.175 7.846 4.397 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.540 5.686 5.325 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -8.583 6.849 7.271 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -9.263 8.130 6.288 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -11.569 7.255 6.879 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -10.802 6.140 7.991 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.686 8.712 8.524 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -11.415 8.945 8.360 1.00 0.00 H new ATOM 0 HE ARG A 61 -10.049 7.644 10.550 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -13.000 7.574 8.613 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -13.968 6.857 9.905 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -11.299 6.724 12.204 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -13.010 6.378 11.930 1.00 0.00 H new ATOM 901 N ASN A 62 -11.607 5.074 4.913 1.00 0.00 N ATOM 902 CA ASN A 62 -12.674 4.090 5.059 1.00 0.00 C ATOM 903 C ASN A 62 -12.429 2.885 4.156 1.00 0.00 C ATOM 904 O ASN A 62 -12.888 1.780 4.441 1.00 0.00 O ATOM 905 CB ASN A 62 -14.027 4.722 4.728 1.00 0.00 C ATOM 906 CG ASN A 62 -13.936 5.724 3.593 1.00 0.00 C ATOM 907 OD1 ASN A 62 -12.952 5.752 2.853 1.00 0.00 O ATOM 908 ND2 ASN A 62 -14.964 6.553 3.451 1.00 0.00 N ATOM 0 H ASN A 62 -11.747 5.739 4.152 1.00 0.00 H new ATOM 0 HA ASN A 62 -12.683 3.750 6.095 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -14.735 3.938 4.461 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -14.420 5.218 5.616 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.959 7.249 2.705 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -15.759 6.494 4.088 1.00 0.00 H new ATOM 915 N ALA A 63 -11.700 3.107 3.067 1.00 0.00 N ATOM 916 CA ALA A 63 -11.391 2.039 2.124 1.00 0.00 C ATOM 917 C ALA A 63 -10.155 1.261 2.561 1.00 0.00 C ATOM 918 O ALA A 63 -10.104 0.037 2.438 1.00 0.00 O ATOM 919 CB ALA A 63 -11.192 2.609 0.727 1.00 0.00 C ATOM 0 H ALA A 63 -11.313 4.017 2.816 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.235 1.349 2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.962 1.800 0.033 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.104 3.113 0.407 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -10.368 3.322 0.739 1.00 0.00 H new ATOM 925 N ILE A 64 -9.160 1.979 3.072 1.00 0.00 N ATOM 926 CA ILE A 64 -7.924 1.355 3.527 1.00 0.00 C ATOM 927 C ILE A 64 -7.820 1.388 5.048 1.00 0.00 C ATOM 928 O ILE A 64 -8.516 2.156 5.713 1.00 0.00 O ATOM 929 CB ILE A 64 -6.688 2.048 2.924 1.00 0.00 C ATOM 930 CG1 ILE A 64 -5.545 1.045 2.756 1.00 0.00 C ATOM 931 CG2 ILE A 64 -6.253 3.213 3.800 1.00 0.00 C ATOM 932 CD1 ILE A 64 -4.482 1.497 1.779 1.00 0.00 C ATOM 0 H ILE A 64 -9.186 2.993 3.181 1.00 0.00 H new ATOM 0 HA ILE A 64 -7.950 0.319 3.189 1.00 0.00 H new ATOM 0 HB ILE A 64 -6.952 2.437 1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.083 0.868 3.727 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.955 0.093 2.419 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -5.378 3.692 3.360 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -7.065 3.936 3.873 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -6.003 2.846 4.796 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.704 0.737 1.711 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.930 1.647 0.797 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.045 2.434 2.125 1.00 0.00 H new ATOM 944 N HIS A 65 -6.943 0.551 5.594 1.00 0.00 N ATOM 945 CA HIS A 65 -6.745 0.486 7.038 1.00 0.00 C ATOM 946 C HIS A 65 -5.770 -0.630 7.403 1.00 0.00 C ATOM 947 O HIS A 65 -5.503 -1.537 6.614 1.00 0.00 O ATOM 948 CB HIS A 65 -8.081 0.264 7.748 1.00 0.00 C ATOM 949 CG HIS A 65 -9.116 -0.392 6.886 1.00 0.00 C ATOM 950 ND1 HIS A 65 -10.471 -0.237 7.087 1.00 0.00 N ATOM 951 CD2 HIS A 65 -8.987 -1.207 5.813 1.00 0.00 C ATOM 952 CE1 HIS A 65 -11.131 -0.931 6.177 1.00 0.00 C ATOM 953 NE2 HIS A 65 -10.253 -1.528 5.391 1.00 0.00 N ATOM 0 H HIS A 65 -6.359 -0.091 5.059 1.00 0.00 H new ATOM 0 HA HIS A 65 -6.322 1.436 7.365 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -7.915 -0.350 8.633 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -8.463 1.224 8.093 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -8.060 -1.542 5.371 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -12.205 -0.999 6.090 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -10.479 -2.130 4.599 1.00 0.00 H new ATOM 962 N PRO A 66 -5.225 -0.563 8.626 1.00 0.00 N ATOM 963 CA PRO A 66 -4.271 -1.559 9.123 1.00 0.00 C ATOM 964 C PRO A 66 -4.927 -2.911 9.382 1.00 0.00 C ATOM 965 O PRO A 66 -5.864 -3.016 10.173 1.00 0.00 O ATOM 966 CB PRO A 66 -3.770 -0.948 10.434 1.00 0.00 C ATOM 967 CG PRO A 66 -4.871 -0.046 10.876 1.00 0.00 C ATOM 968 CD PRO A 66 -5.498 0.490 9.619 1.00 0.00 C ATOM 0 HA PRO A 66 -3.480 -1.761 8.401 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -3.567 -1.718 11.178 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -2.842 -0.396 10.285 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -5.602 -0.588 11.476 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -4.487 0.764 11.496 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -6.568 0.657 9.743 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.058 1.443 9.325 1.00 0.00 H new ATOM 976 N GLY A 67 -4.428 -3.945 8.711 1.00 0.00 N ATOM 977 CA GLY A 67 -4.978 -5.276 8.883 1.00 0.00 C ATOM 978 C GLY A 67 -5.470 -5.874 7.580 1.00 0.00 C ATOM 979 O GLY A 67 -5.958 -7.004 7.552 1.00 0.00 O ATOM 0 H GLY A 67 -3.652 -3.884 8.051 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.217 -5.927 9.313 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -5.803 -5.236 9.595 1.00 0.00 H new ATOM 983 N ASP A 68 -5.345 -5.113 6.498 1.00 0.00 N ATOM 984 CA ASP A 68 -5.781 -5.573 5.185 1.00 0.00 C ATOM 985 C ASP A 68 -4.588 -5.986 4.329 1.00 0.00 C ATOM 986 O ASP A 68 -3.436 -5.761 4.703 1.00 0.00 O ATOM 987 CB ASP A 68 -6.579 -4.478 4.476 1.00 0.00 C ATOM 988 CG ASP A 68 -8.070 -4.753 4.478 1.00 0.00 C ATOM 989 OD1 ASP A 68 -8.497 -5.714 3.803 1.00 0.00 O ATOM 990 OD2 ASP A 68 -8.809 -4.009 5.154 1.00 0.00 O ATOM 0 H ASP A 68 -4.945 -4.175 6.505 1.00 0.00 H new ATOM 0 HA ASP A 68 -6.421 -6.444 5.327 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -6.389 -3.521 4.962 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.231 -4.387 3.447 1.00 0.00 H new ATOM 995 N ARG A 69 -4.871 -6.591 3.180 1.00 0.00 N ATOM 996 CA ARG A 69 -3.820 -7.037 2.273 1.00 0.00 C ATOM 997 C ARG A 69 -4.036 -6.472 0.872 1.00 0.00 C ATOM 998 O ARG A 69 -5.073 -6.707 0.250 1.00 0.00 O ATOM 999 CB ARG A 69 -3.780 -8.565 2.217 1.00 0.00 C ATOM 1000 CG ARG A 69 -5.154 -9.208 2.135 1.00 0.00 C ATOM 1001 CD ARG A 69 -5.081 -10.710 2.365 1.00 0.00 C ATOM 1002 NE ARG A 69 -6.384 -11.276 2.703 1.00 0.00 N ATOM 1003 CZ ARG A 69 -6.898 -11.258 3.928 1.00 0.00 C ATOM 1004 NH1 ARG A 69 -6.222 -10.705 4.925 1.00 0.00 N ATOM 1005 NH2 ARG A 69 -8.090 -11.793 4.156 1.00 0.00 N ATOM 0 H ARG A 69 -5.819 -6.783 2.855 1.00 0.00 H new ATOM 0 HA ARG A 69 -2.867 -6.669 2.652 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -3.192 -8.873 1.352 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.265 -8.939 3.102 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -5.813 -8.757 2.877 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.592 -9.009 1.157 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -4.696 -11.196 1.468 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -4.375 -10.920 3.169 1.00 0.00 H new ATOM 0 HE ARG A 69 -6.929 -11.709 1.958 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.305 -10.292 4.753 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -6.618 -10.692 5.865 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -8.613 -12.219 3.391 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -8.484 -11.779 5.097 1.00 0.00 H new ATOM 1019 N ILE A 70 -3.051 -5.727 0.382 1.00 0.00 N ATOM 1020 CA ILE A 70 -3.134 -5.129 -0.945 1.00 0.00 C ATOM 1021 C ILE A 70 -2.946 -6.180 -2.034 1.00 0.00 C ATOM 1022 O ILE A 70 -2.028 -6.999 -1.971 1.00 0.00 O ATOM 1023 CB ILE A 70 -2.080 -4.021 -1.130 1.00 0.00 C ATOM 1024 CG1 ILE A 70 -2.533 -2.736 -0.434 1.00 0.00 C ATOM 1025 CG2 ILE A 70 -1.831 -3.769 -2.610 1.00 0.00 C ATOM 1026 CD1 ILE A 70 -1.484 -2.144 0.482 1.00 0.00 C ATOM 0 H ILE A 70 -2.187 -5.523 0.884 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.129 -4.692 -1.033 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.145 -4.349 -0.675 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.802 -1.998 -1.190 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.434 -2.943 0.144 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.084 -2.984 -2.725 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.470 -4.684 -3.079 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.760 -3.458 -3.088 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.873 -1.235 0.942 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.232 -2.865 1.260 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.590 -1.905 -0.095 1.00 0.00 H new ATOM 1038 N LEU A 71 -3.821 -6.152 -3.033 1.00 0.00 N ATOM 1039 CA LEU A 71 -3.751 -7.101 -4.139 1.00 0.00 C ATOM 1040 C LEU A 71 -2.999 -6.503 -5.323 1.00 0.00 C ATOM 1041 O LEU A 71 -2.152 -7.161 -5.927 1.00 0.00 O ATOM 1042 CB LEU A 71 -5.159 -7.515 -4.571 1.00 0.00 C ATOM 1043 CG LEU A 71 -6.189 -7.664 -3.450 1.00 0.00 C ATOM 1044 CD1 LEU A 71 -7.486 -8.245 -3.991 1.00 0.00 C ATOM 1045 CD2 LEU A 71 -5.637 -8.536 -2.332 1.00 0.00 C ATOM 0 H LEU A 71 -4.588 -5.482 -3.100 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.209 -7.982 -3.796 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.530 -6.778 -5.283 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.090 -8.464 -5.102 1.00 0.00 H new ATOM 0 HG LEU A 71 -6.400 -6.675 -3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -8.207 -8.344 -3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.890 -7.583 -4.757 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.292 -9.226 -4.425 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.383 -8.631 -1.543 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.397 -9.524 -2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.735 -8.079 -1.925 1.00 0.00 H new ATOM 1057 N GLU A 72 -3.312 -5.253 -5.647 1.00 0.00 N ATOM 1058 CA GLU A 72 -2.664 -4.567 -6.759 1.00 0.00 C ATOM 1059 C GLU A 72 -2.372 -3.112 -6.404 1.00 0.00 C ATOM 1060 O GLU A 72 -3.172 -2.451 -5.741 1.00 0.00 O ATOM 1061 CB GLU A 72 -3.542 -4.632 -8.010 1.00 0.00 C ATOM 1062 CG GLU A 72 -3.848 -6.049 -8.465 1.00 0.00 C ATOM 1063 CD GLU A 72 -4.361 -6.105 -9.891 1.00 0.00 C ATOM 1064 OE1 GLU A 72 -3.529 -6.193 -10.818 1.00 0.00 O ATOM 1065 OE2 GLU A 72 -5.594 -6.062 -10.080 1.00 0.00 O ATOM 0 H GLU A 72 -4.010 -4.695 -5.156 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.719 -5.071 -6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.480 -4.112 -7.813 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.046 -4.098 -8.820 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.946 -6.656 -8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.590 -6.489 -7.798 1.00 0.00 H new ATOM 1072 N ILE A 73 -1.221 -2.620 -6.849 1.00 0.00 N ATOM 1073 CA ILE A 73 -0.824 -1.243 -6.580 1.00 0.00 C ATOM 1074 C ILE A 73 -0.704 -0.442 -7.872 1.00 0.00 C ATOM 1075 O ILE A 73 0.069 -0.793 -8.762 1.00 0.00 O ATOM 1076 CB ILE A 73 0.518 -1.182 -5.825 1.00 0.00 C ATOM 1077 CG1 ILE A 73 0.407 -1.909 -4.483 1.00 0.00 C ATOM 1078 CG2 ILE A 73 0.943 0.264 -5.617 1.00 0.00 C ATOM 1079 CD1 ILE A 73 1.634 -1.760 -3.612 1.00 0.00 C ATOM 0 H ILE A 73 -0.547 -3.154 -7.397 1.00 0.00 H new ATOM 0 HA ILE A 73 -1.604 -0.806 -5.956 1.00 0.00 H new ATOM 0 HB ILE A 73 1.279 -1.681 -6.425 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -0.460 -1.528 -3.943 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.228 -2.968 -4.667 1.00 0.00 H new ATOM 0 HG21 ILE A 73 1.893 0.291 -5.082 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.057 0.752 -6.585 1.00 0.00 H new ATOM 0 HG23 ILE A 73 0.184 0.786 -5.035 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.485 -2.301 -2.677 1.00 0.00 H new ATOM 0 HD12 ILE A 73 2.501 -2.167 -4.132 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.802 -0.705 -3.398 1.00 0.00 H new ATOM 1091 N ASN A 74 -1.475 0.636 -7.966 1.00 0.00 N ATOM 1092 CA ASN A 74 -1.455 1.489 -9.149 1.00 0.00 C ATOM 1093 C ASN A 74 -1.986 0.740 -10.368 1.00 0.00 C ATOM 1094 O ASN A 74 -1.750 1.141 -11.507 1.00 0.00 O ATOM 1095 CB ASN A 74 -0.034 1.986 -9.421 1.00 0.00 C ATOM 1096 CG ASN A 74 0.155 3.439 -9.031 1.00 0.00 C ATOM 1097 OD1 ASN A 74 0.310 4.308 -9.889 1.00 0.00 O ATOM 1098 ND2 ASN A 74 0.143 3.709 -7.731 1.00 0.00 N ATOM 0 H ASN A 74 -2.121 0.940 -7.238 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.102 2.346 -8.960 1.00 0.00 H new ATOM 0 HB2 ASN A 74 0.675 1.369 -8.869 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.194 1.864 -10.480 1.00 0.00 H new ATOM 0 HD21 ASN A 74 0.265 4.669 -7.408 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.011 2.957 -7.055 1.00 0.00 H new ATOM 1105 N GLY A 75 -2.705 -0.350 -10.119 1.00 0.00 N ATOM 1106 CA GLY A 75 -3.259 -1.137 -11.206 1.00 0.00 C ATOM 1107 C GLY A 75 -2.296 -2.197 -11.703 1.00 0.00 C ATOM 1108 O GLY A 75 -2.298 -2.544 -12.885 1.00 0.00 O ATOM 0 H GLY A 75 -2.914 -0.702 -9.185 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.180 -1.615 -10.872 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.524 -0.476 -12.031 1.00 0.00 H new ATOM 1112 N THR A 76 -1.467 -2.713 -10.800 1.00 0.00 N ATOM 1113 CA THR A 76 -0.493 -3.737 -11.153 1.00 0.00 C ATOM 1114 C THR A 76 -0.454 -4.844 -10.107 1.00 0.00 C ATOM 1115 O THR A 76 -0.635 -4.609 -8.912 1.00 0.00 O ATOM 1116 CB THR A 76 0.919 -3.140 -11.305 1.00 0.00 C ATOM 1117 OG1 THR A 76 0.912 -1.761 -10.918 1.00 0.00 O ATOM 1118 CG2 THR A 76 1.409 -3.267 -12.740 1.00 0.00 C ATOM 0 H THR A 76 -1.452 -2.437 -9.818 1.00 0.00 H new ATOM 0 HA THR A 76 -0.808 -4.156 -12.109 1.00 0.00 H new ATOM 0 HB THR A 76 1.596 -3.696 -10.656 1.00 0.00 H new ATOM 0 HG1 THR A 76 0.753 -1.693 -9.953 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.408 -2.839 -12.823 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.441 -4.319 -13.022 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.729 -2.734 -13.405 1.00 0.00 H new ATOM 1126 N PRO A 77 -0.212 -6.082 -10.562 1.00 0.00 N ATOM 1127 CA PRO A 77 -0.143 -7.251 -9.680 1.00 0.00 C ATOM 1128 C PRO A 77 1.094 -7.232 -8.788 1.00 0.00 C ATOM 1129 O PRO A 77 2.223 -7.192 -9.277 1.00 0.00 O ATOM 1130 CB PRO A 77 -0.080 -8.429 -10.656 1.00 0.00 C ATOM 1131 CG PRO A 77 0.501 -7.857 -11.902 1.00 0.00 C ATOM 1132 CD PRO A 77 0.013 -6.437 -11.974 1.00 0.00 C ATOM 0 HA PRO A 77 -0.988 -7.293 -8.993 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.540 -9.235 -10.264 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.070 -8.847 -10.836 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.590 -7.894 -11.877 1.00 0.00 H new ATOM 0 HG3 PRO A 77 0.182 -8.424 -12.777 1.00 0.00 H new ATOM 0 HD2 PRO A 77 0.749 -5.782 -12.441 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.903 -6.356 -12.560 1.00 0.00 H new ATOM 1140 N VAL A 78 0.873 -7.260 -7.478 1.00 0.00 N ATOM 1141 CA VAL A 78 1.970 -7.247 -6.517 1.00 0.00 C ATOM 1142 C VAL A 78 2.683 -8.594 -6.480 1.00 0.00 C ATOM 1143 O VAL A 78 3.770 -8.717 -5.914 1.00 0.00 O ATOM 1144 CB VAL A 78 1.473 -6.902 -5.101 1.00 0.00 C ATOM 1145 CG1 VAL A 78 0.777 -5.550 -5.094 1.00 0.00 C ATOM 1146 CG2 VAL A 78 0.545 -7.991 -4.583 1.00 0.00 C ATOM 0 H VAL A 78 -0.056 -7.292 -7.057 1.00 0.00 H new ATOM 0 HA VAL A 78 2.669 -6.478 -6.845 1.00 0.00 H new ATOM 0 HB VAL A 78 2.335 -6.843 -4.436 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.433 -5.323 -4.085 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.475 -4.780 -5.421 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.077 -5.577 -5.771 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.203 -7.731 -3.581 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.314 -8.083 -5.247 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.081 -8.940 -4.549 1.00 0.00 H new ATOM 1156 N ARG A 79 2.065 -9.602 -7.086 1.00 0.00 N ATOM 1157 CA ARG A 79 2.640 -10.941 -7.121 1.00 0.00 C ATOM 1158 C ARG A 79 3.713 -11.044 -8.202 1.00 0.00 C ATOM 1159 O ARG A 79 4.456 -12.024 -8.264 1.00 0.00 O ATOM 1160 CB ARG A 79 1.548 -11.982 -7.372 1.00 0.00 C ATOM 1161 CG ARG A 79 0.728 -11.716 -8.624 1.00 0.00 C ATOM 1162 CD ARG A 79 -0.763 -11.819 -8.346 1.00 0.00 C ATOM 1163 NE ARG A 79 -1.086 -12.975 -7.514 1.00 0.00 N ATOM 1164 CZ ARG A 79 -1.135 -14.221 -7.973 1.00 0.00 C ATOM 1165 NH1 ARG A 79 -0.884 -14.470 -9.251 1.00 0.00 N ATOM 1166 NH2 ARG A 79 -1.436 -15.220 -7.154 1.00 0.00 N ATOM 0 H ARG A 79 1.166 -9.517 -7.560 1.00 0.00 H new ATOM 0 HA ARG A 79 3.103 -11.135 -6.153 1.00 0.00 H new ATOM 0 HB2 ARG A 79 2.008 -12.967 -7.452 1.00 0.00 H new ATOM 0 HB3 ARG A 79 0.881 -12.011 -6.511 1.00 0.00 H new ATOM 0 HG2 ARG A 79 0.960 -10.722 -9.008 1.00 0.00 H new ATOM 0 HG3 ARG A 79 1.005 -12.430 -9.400 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.103 -10.910 -7.851 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -1.304 -11.889 -9.290 1.00 0.00 H new ATOM 0 HE ARG A 79 -1.285 -12.817 -6.526 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -0.653 -13.704 -9.884 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -0.922 -15.427 -9.601 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -1.630 -15.032 -6.170 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -1.473 -16.176 -7.508 1.00 0.00 H new ATOM 1180 N THR A 80 3.788 -10.025 -9.053 1.00 0.00 N ATOM 1181 CA THR A 80 4.768 -10.001 -10.132 1.00 0.00 C ATOM 1182 C THR A 80 5.740 -8.839 -9.965 1.00 0.00 C ATOM 1183 O THR A 80 6.906 -8.932 -10.350 1.00 0.00 O ATOM 1184 CB THR A 80 4.085 -9.891 -11.508 1.00 0.00 C ATOM 1185 OG1 THR A 80 3.877 -8.515 -11.843 1.00 0.00 O ATOM 1186 CG2 THR A 80 2.753 -10.626 -11.512 1.00 0.00 C ATOM 0 H THR A 80 3.182 -9.206 -9.016 1.00 0.00 H new ATOM 0 HA THR A 80 5.318 -10.941 -10.082 1.00 0.00 H new ATOM 0 HB THR A 80 4.738 -10.351 -12.250 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.593 -8.445 -12.779 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.290 -10.534 -12.494 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.918 -11.679 -11.286 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.096 -10.192 -10.759 1.00 0.00 H new ATOM 1194 N LEU A 81 5.254 -7.745 -9.390 1.00 0.00 N ATOM 1195 CA LEU A 81 6.081 -6.563 -9.171 1.00 0.00 C ATOM 1196 C LEU A 81 7.274 -6.891 -8.278 1.00 0.00 C ATOM 1197 O LEU A 81 7.159 -7.672 -7.334 1.00 0.00 O ATOM 1198 CB LEU A 81 5.250 -5.444 -8.541 1.00 0.00 C ATOM 1199 CG LEU A 81 4.270 -4.730 -9.473 1.00 0.00 C ATOM 1200 CD1 LEU A 81 3.584 -3.582 -8.748 1.00 0.00 C ATOM 1201 CD2 LEU A 81 4.988 -4.225 -10.716 1.00 0.00 C ATOM 0 H LEU A 81 4.291 -7.651 -9.067 1.00 0.00 H new ATOM 0 HA LEU A 81 6.456 -6.228 -10.138 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.687 -5.862 -7.706 1.00 0.00 H new ATOM 0 HB3 LEU A 81 5.932 -4.702 -8.126 1.00 0.00 H new ATOM 0 HG LEU A 81 3.507 -5.444 -9.783 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.890 -3.086 -9.427 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.036 -3.970 -7.889 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.333 -2.867 -8.408 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.275 -3.720 -11.368 1.00 0.00 H new ATOM 0 HD22 LEU A 81 5.772 -3.526 -10.425 1.00 0.00 H new ATOM 0 HD23 LEU A 81 5.432 -5.067 -11.247 1.00 0.00 H new ATOM 1213 N ARG A 82 8.418 -6.286 -8.582 1.00 0.00 N ATOM 1214 CA ARG A 82 9.631 -6.513 -7.807 1.00 0.00 C ATOM 1215 C ARG A 82 9.501 -5.918 -6.408 1.00 0.00 C ATOM 1216 O ARG A 82 8.675 -5.037 -6.170 1.00 0.00 O ATOM 1217 CB ARG A 82 10.840 -5.904 -8.521 1.00 0.00 C ATOM 1218 CG ARG A 82 10.998 -6.374 -9.958 1.00 0.00 C ATOM 1219 CD ARG A 82 12.158 -7.348 -10.101 1.00 0.00 C ATOM 1220 NE ARG A 82 12.050 -8.152 -11.315 1.00 0.00 N ATOM 1221 CZ ARG A 82 11.275 -9.226 -11.419 1.00 0.00 C ATOM 1222 NH1 ARG A 82 10.543 -9.622 -10.387 1.00 0.00 N ATOM 1223 NH2 ARG A 82 11.231 -9.906 -12.557 1.00 0.00 N ATOM 0 H ARG A 82 8.530 -5.635 -9.359 1.00 0.00 H new ATOM 0 HA ARG A 82 9.777 -7.589 -7.714 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.748 -4.818 -8.511 1.00 0.00 H new ATOM 0 HB3 ARG A 82 11.744 -6.153 -7.965 1.00 0.00 H new ATOM 0 HG2 ARG A 82 10.076 -6.853 -10.289 1.00 0.00 H new ATOM 0 HG3 ARG A 82 11.161 -5.514 -10.607 1.00 0.00 H new ATOM 0 HD2 ARG A 82 13.097 -6.794 -10.115 1.00 0.00 H new ATOM 0 HD3 ARG A 82 12.189 -8.005 -9.232 1.00 0.00 H new ATOM 0 HE ARG A 82 12.600 -7.874 -12.128 1.00 0.00 H new ATOM 0 HH11 ARG A 82 10.574 -9.102 -9.510 1.00 0.00 H new ATOM 0 HH12 ARG A 82 9.949 -10.447 -10.470 1.00 0.00 H new ATOM 0 HH21 ARG A 82 11.793 -9.604 -13.353 1.00 0.00 H new ATOM 0 HH22 ARG A 82 10.636 -10.730 -12.636 1.00 0.00 H new ATOM 1237 N VAL A 83 10.323 -6.407 -5.484 1.00 0.00 N ATOM 1238 CA VAL A 83 10.301 -5.924 -4.109 1.00 0.00 C ATOM 1239 C VAL A 83 10.388 -4.402 -4.059 1.00 0.00 C ATOM 1240 O VAL A 83 9.445 -3.730 -3.643 1.00 0.00 O ATOM 1241 CB VAL A 83 11.457 -6.521 -3.285 1.00 0.00 C ATOM 1242 CG1 VAL A 83 11.517 -5.882 -1.906 1.00 0.00 C ATOM 1243 CG2 VAL A 83 11.309 -8.031 -3.176 1.00 0.00 C ATOM 0 H VAL A 83 11.012 -7.137 -5.663 1.00 0.00 H new ATOM 0 HA VAL A 83 9.353 -6.245 -3.676 1.00 0.00 H new ATOM 0 HB VAL A 83 12.394 -6.307 -3.799 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.340 -6.317 -1.339 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.675 -4.808 -2.009 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.579 -6.062 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 83 12.134 -8.436 -2.591 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.365 -8.270 -2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 83 11.321 -8.471 -4.173 1.00 0.00 H new ATOM 1253 N GLU A 84 11.527 -3.866 -4.486 1.00 0.00 N ATOM 1254 CA GLU A 84 11.738 -2.423 -4.489 1.00 0.00 C ATOM 1255 C GLU A 84 10.553 -1.703 -5.126 1.00 0.00 C ATOM 1256 O GLU A 84 10.274 -0.547 -4.809 1.00 0.00 O ATOM 1257 CB GLU A 84 13.024 -2.075 -5.241 1.00 0.00 C ATOM 1258 CG GLU A 84 13.126 -2.729 -6.609 1.00 0.00 C ATOM 1259 CD GLU A 84 14.527 -3.219 -6.918 1.00 0.00 C ATOM 1260 OE1 GLU A 84 15.294 -3.467 -5.964 1.00 0.00 O ATOM 1261 OE2 GLU A 84 14.857 -3.355 -8.115 1.00 0.00 O ATOM 0 H GLU A 84 12.317 -4.409 -4.834 1.00 0.00 H new ATOM 0 HA GLU A 84 11.830 -2.092 -3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.084 -0.993 -5.360 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.880 -2.378 -4.638 1.00 0.00 H new ATOM 0 HG2 GLU A 84 12.432 -3.568 -6.659 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.818 -2.015 -7.373 1.00 0.00 H new ATOM 1268 N GLU A 85 9.861 -2.394 -6.026 1.00 0.00 N ATOM 1269 CA GLU A 85 8.707 -1.819 -6.708 1.00 0.00 C ATOM 1270 C GLU A 85 7.520 -1.694 -5.758 1.00 0.00 C ATOM 1271 O GLU A 85 6.910 -0.631 -5.645 1.00 0.00 O ATOM 1272 CB GLU A 85 8.321 -2.677 -7.915 1.00 0.00 C ATOM 1273 CG GLU A 85 8.250 -1.899 -9.217 1.00 0.00 C ATOM 1274 CD GLU A 85 7.081 -0.933 -9.257 1.00 0.00 C ATOM 1275 OE1 GLU A 85 6.799 -0.300 -8.219 1.00 0.00 O ATOM 1276 OE2 GLU A 85 6.449 -0.811 -10.328 1.00 0.00 O ATOM 0 H GLU A 85 10.079 -3.352 -6.300 1.00 0.00 H new ATOM 0 HA GLU A 85 8.980 -0.822 -7.053 1.00 0.00 H new ATOM 0 HB2 GLU A 85 9.046 -3.484 -8.023 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.353 -3.141 -7.726 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.179 -1.346 -9.356 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.168 -2.598 -10.049 1.00 0.00 H new ATOM 1283 N VAL A 86 7.198 -2.788 -5.075 1.00 0.00 N ATOM 1284 CA VAL A 86 6.085 -2.802 -4.134 1.00 0.00 C ATOM 1285 C VAL A 86 6.290 -1.776 -3.025 1.00 0.00 C ATOM 1286 O VAL A 86 5.328 -1.227 -2.489 1.00 0.00 O ATOM 1287 CB VAL A 86 5.901 -4.195 -3.502 1.00 0.00 C ATOM 1288 CG1 VAL A 86 4.532 -4.309 -2.849 1.00 0.00 C ATOM 1289 CG2 VAL A 86 6.096 -5.283 -4.546 1.00 0.00 C ATOM 0 H VAL A 86 7.693 -3.676 -5.156 1.00 0.00 H new ATOM 0 HA VAL A 86 5.189 -2.547 -4.700 1.00 0.00 H new ATOM 0 HB VAL A 86 6.657 -4.327 -2.728 1.00 0.00 H new ATOM 0 HG11 VAL A 86 4.421 -5.300 -2.408 1.00 0.00 H new ATOM 0 HG12 VAL A 86 4.436 -3.552 -2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.757 -4.157 -3.600 1.00 0.00 H new ATOM 0 HG21 VAL A 86 5.962 -6.260 -4.082 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.364 -5.157 -5.344 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.101 -5.213 -4.961 1.00 0.00 H new ATOM 1299 N GLU A 87 7.550 -1.522 -2.687 1.00 0.00 N ATOM 1300 CA GLU A 87 7.881 -0.561 -1.642 1.00 0.00 C ATOM 1301 C GLU A 87 7.823 0.867 -2.177 1.00 0.00 C ATOM 1302 O GLU A 87 7.232 1.751 -1.556 1.00 0.00 O ATOM 1303 CB GLU A 87 9.273 -0.849 -1.075 1.00 0.00 C ATOM 1304 CG GLU A 87 9.312 -2.043 -0.137 1.00 0.00 C ATOM 1305 CD GLU A 87 10.291 -1.855 1.006 1.00 0.00 C ATOM 1306 OE1 GLU A 87 11.119 -0.923 0.930 1.00 0.00 O ATOM 1307 OE2 GLU A 87 10.230 -2.639 1.976 1.00 0.00 O ATOM 0 H GLU A 87 8.358 -1.968 -3.121 1.00 0.00 H new ATOM 0 HA GLU A 87 7.144 -0.662 -0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.963 -1.023 -1.900 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.629 0.033 -0.542 1.00 0.00 H new ATOM 0 HG2 GLU A 87 8.315 -2.215 0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.585 -2.935 -0.701 1.00 0.00 H new ATOM 1314 N ASP A 88 8.442 1.085 -3.332 1.00 0.00 N ATOM 1315 CA ASP A 88 8.461 2.404 -3.952 1.00 0.00 C ATOM 1316 C ASP A 88 7.044 2.937 -4.142 1.00 0.00 C ATOM 1317 O ASP A 88 6.739 4.066 -3.762 1.00 0.00 O ATOM 1318 CB ASP A 88 9.183 2.348 -5.300 1.00 0.00 C ATOM 1319 CG ASP A 88 10.634 2.776 -5.198 1.00 0.00 C ATOM 1320 OD1 ASP A 88 10.924 3.709 -4.419 1.00 0.00 O ATOM 1321 OD2 ASP A 88 11.480 2.179 -5.897 1.00 0.00 O ATOM 0 H ASP A 88 8.937 0.365 -3.858 1.00 0.00 H new ATOM 0 HA ASP A 88 8.999 3.081 -3.288 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.134 1.333 -5.693 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.667 2.991 -6.012 1.00 0.00 H new ATOM 1326 N ALA A 89 6.184 2.115 -4.735 1.00 0.00 N ATOM 1327 CA ALA A 89 4.799 2.503 -4.974 1.00 0.00 C ATOM 1328 C ALA A 89 4.208 3.207 -3.758 1.00 0.00 C ATOM 1329 O ALA A 89 3.277 4.003 -3.883 1.00 0.00 O ATOM 1330 CB ALA A 89 3.965 1.283 -5.338 1.00 0.00 C ATOM 0 H ALA A 89 6.422 1.177 -5.058 1.00 0.00 H new ATOM 0 HA ALA A 89 4.783 3.203 -5.809 1.00 0.00 H new ATOM 0 HB1 ALA A 89 2.933 1.587 -5.514 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.367 0.824 -6.241 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.997 0.563 -4.520 1.00 0.00 H new ATOM 1336 N ILE A 90 4.753 2.908 -2.584 1.00 0.00 N ATOM 1337 CA ILE A 90 4.279 3.514 -1.346 1.00 0.00 C ATOM 1338 C ILE A 90 5.118 4.731 -0.972 1.00 0.00 C ATOM 1339 O ILE A 90 4.608 5.705 -0.419 1.00 0.00 O ATOM 1340 CB ILE A 90 4.307 2.507 -0.180 1.00 0.00 C ATOM 1341 CG1 ILE A 90 4.196 1.077 -0.710 1.00 0.00 C ATOM 1342 CG2 ILE A 90 3.184 2.803 0.802 1.00 0.00 C ATOM 1343 CD1 ILE A 90 3.005 0.859 -1.618 1.00 0.00 C ATOM 0 H ILE A 90 5.523 2.250 -2.464 1.00 0.00 H new ATOM 0 HA ILE A 90 3.250 3.826 -1.522 1.00 0.00 H new ATOM 0 HB ILE A 90 5.257 2.607 0.344 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.107 0.828 -1.254 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.130 0.390 0.133 1.00 0.00 H new ATOM 0 HG21 ILE A 90 3.217 2.083 1.620 1.00 0.00 H new ATOM 0 HG22 ILE A 90 3.305 3.811 1.200 1.00 0.00 H new ATOM 0 HG23 ILE A 90 2.224 2.728 0.291 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.990 -0.177 -1.956 1.00 0.00 H new ATOM 0 HD12 ILE A 90 2.087 1.076 -1.072 1.00 0.00 H new ATOM 0 HD13 ILE A 90 3.079 1.521 -2.481 1.00 0.00 H new ATOM 1355 N LYS A 91 6.409 4.669 -1.281 1.00 0.00 N ATOM 1356 CA LYS A 91 7.321 5.767 -0.981 1.00 0.00 C ATOM 1357 C LYS A 91 7.226 6.859 -2.043 1.00 0.00 C ATOM 1358 O LYS A 91 7.893 7.888 -1.948 1.00 0.00 O ATOM 1359 CB LYS A 91 8.759 5.253 -0.891 1.00 0.00 C ATOM 1360 CG LYS A 91 8.935 4.105 0.089 1.00 0.00 C ATOM 1361 CD LYS A 91 10.336 4.083 0.676 1.00 0.00 C ATOM 1362 CE LYS A 91 10.800 2.662 0.956 1.00 0.00 C ATOM 1363 NZ LYS A 91 12.175 2.630 1.527 1.00 0.00 N ATOM 0 H LYS A 91 6.847 3.870 -1.739 1.00 0.00 H new ATOM 0 HA LYS A 91 7.033 6.193 -0.020 1.00 0.00 H new ATOM 0 HB2 LYS A 91 9.082 4.928 -1.880 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.412 6.075 -0.596 1.00 0.00 H new ATOM 0 HG2 LYS A 91 8.204 4.196 0.893 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.737 3.160 -0.417 1.00 0.00 H new ATOM 0 HD2 LYS A 91 11.029 4.564 -0.015 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.354 4.662 1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.108 2.184 1.649 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.777 2.084 0.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.455 1.644 1.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.840 3.063 0.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.192 3.160 2.422 1.00 0.00 H new ATOM 1377 N GLN A 92 6.392 6.626 -3.051 1.00 0.00 N ATOM 1378 CA GLN A 92 6.210 7.591 -4.129 1.00 0.00 C ATOM 1379 C GLN A 92 5.165 8.637 -3.753 1.00 0.00 C ATOM 1380 O GLN A 92 3.977 8.332 -3.643 1.00 0.00 O ATOM 1381 CB GLN A 92 5.793 6.876 -5.416 1.00 0.00 C ATOM 1382 CG GLN A 92 4.419 6.231 -5.336 1.00 0.00 C ATOM 1383 CD GLN A 92 3.363 7.010 -6.095 1.00 0.00 C ATOM 1384 OE1 GLN A 92 2.317 7.358 -5.546 1.00 0.00 O ATOM 1385 NE2 GLN A 92 3.632 7.289 -7.365 1.00 0.00 N ATOM 0 H GLN A 92 5.832 5.778 -3.144 1.00 0.00 H new ATOM 0 HA GLN A 92 7.161 8.097 -4.294 1.00 0.00 H new ATOM 0 HB2 GLN A 92 5.802 7.591 -6.238 1.00 0.00 H new ATOM 0 HB3 GLN A 92 6.532 6.110 -5.652 1.00 0.00 H new ATOM 0 HG2 GLN A 92 4.474 5.218 -5.734 1.00 0.00 H new ATOM 0 HG3 GLN A 92 4.122 6.147 -4.291 1.00 0.00 H new ATOM 0 HE21 GLN A 92 4.512 6.981 -7.780 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.959 7.811 -7.926 1.00 0.00 H new ATOM 1394 N THR A 93 5.616 9.872 -3.556 1.00 0.00 N ATOM 1395 CA THR A 93 4.722 10.963 -3.191 1.00 0.00 C ATOM 1396 C THR A 93 4.808 12.105 -4.197 1.00 0.00 C ATOM 1397 O THR A 93 4.910 13.272 -3.818 1.00 0.00 O ATOM 1398 CB THR A 93 5.043 11.506 -1.786 1.00 0.00 C ATOM 1399 OG1 THR A 93 6.326 12.142 -1.788 1.00 0.00 O ATOM 1400 CG2 THR A 93 5.027 10.386 -0.756 1.00 0.00 C ATOM 0 H THR A 93 6.596 10.141 -3.643 1.00 0.00 H new ATOM 0 HA THR A 93 3.711 10.557 -3.193 1.00 0.00 H new ATOM 0 HB THR A 93 4.278 12.235 -1.518 1.00 0.00 H new ATOM 0 HG1 THR A 93 6.309 12.910 -2.397 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.256 10.794 0.228 1.00 0.00 H new ATOM 0 HG22 THR A 93 4.040 9.924 -0.736 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.773 9.637 -1.021 1.00 0.00 H new ATOM 1408 N SER A 94 4.766 11.761 -5.480 1.00 0.00 N ATOM 1409 CA SER A 94 4.842 12.759 -6.541 1.00 0.00 C ATOM 1410 C SER A 94 3.520 12.850 -7.297 1.00 0.00 C ATOM 1411 O SER A 94 3.105 13.932 -7.713 1.00 0.00 O ATOM 1412 CB SER A 94 5.975 12.416 -7.511 1.00 0.00 C ATOM 1413 OG SER A 94 6.072 13.382 -8.544 1.00 0.00 O ATOM 0 H SER A 94 4.680 10.800 -5.810 1.00 0.00 H new ATOM 0 HA SER A 94 5.045 13.727 -6.083 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.919 12.363 -6.968 1.00 0.00 H new ATOM 0 HB3 SER A 94 5.801 11.431 -7.945 1.00 0.00 H new ATOM 0 HG SER A 94 6.804 13.141 -9.149 1.00 0.00 H new ATOM 1419 N GLN A 95 2.865 11.707 -7.471 1.00 0.00 N ATOM 1420 CA GLN A 95 1.590 11.658 -8.177 1.00 0.00 C ATOM 1421 C GLN A 95 0.556 10.868 -7.381 1.00 0.00 C ATOM 1422 O GLN A 95 0.770 10.547 -6.211 1.00 0.00 O ATOM 1423 CB GLN A 95 1.774 11.030 -9.560 1.00 0.00 C ATOM 1424 CG GLN A 95 3.216 10.672 -9.879 1.00 0.00 C ATOM 1425 CD GLN A 95 3.440 10.411 -11.356 1.00 0.00 C ATOM 1426 OE1 GLN A 95 3.383 9.268 -11.811 1.00 0.00 O ATOM 1427 NE2 GLN A 95 3.695 11.472 -12.113 1.00 0.00 N ATOM 0 H GLN A 95 3.196 10.803 -7.133 1.00 0.00 H new ATOM 0 HA GLN A 95 1.228 12.680 -8.294 1.00 0.00 H new ATOM 0 HB2 GLN A 95 1.162 10.130 -9.626 1.00 0.00 H new ATOM 0 HB3 GLN A 95 1.405 11.723 -10.316 1.00 0.00 H new ATOM 0 HG2 GLN A 95 3.868 11.483 -9.554 1.00 0.00 H new ATOM 0 HG3 GLN A 95 3.501 9.787 -9.310 1.00 0.00 H new ATOM 0 HE21 GLN A 95 3.733 12.401 -11.693 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.853 11.358 -13.114 1.00 0.00 H new ATOM 1436 N THR A 96 -0.566 10.558 -8.022 1.00 0.00 N ATOM 1437 CA THR A 96 -1.634 9.807 -7.373 1.00 0.00 C ATOM 1438 C THR A 96 -1.218 8.362 -7.125 1.00 0.00 C ATOM 1439 O THR A 96 -0.427 7.794 -7.880 1.00 0.00 O ATOM 1440 CB THR A 96 -2.923 9.820 -8.217 1.00 0.00 C ATOM 1441 OG1 THR A 96 -2.918 10.947 -9.100 1.00 0.00 O ATOM 1442 CG2 THR A 96 -4.153 9.875 -7.324 1.00 0.00 C ATOM 0 H THR A 96 -0.759 10.815 -8.990 1.00 0.00 H new ATOM 0 HA THR A 96 -1.828 10.295 -6.418 1.00 0.00 H new ATOM 0 HB THR A 96 -2.958 8.901 -8.802 1.00 0.00 H new ATOM 0 HG1 THR A 96 -3.740 10.948 -9.634 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.051 9.883 -7.942 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.169 9.001 -6.672 1.00 0.00 H new ATOM 0 HG23 THR A 96 -4.122 10.780 -6.717 1.00 0.00 H new ATOM 1450 N LEU A 97 -1.754 7.771 -6.063 1.00 0.00 N ATOM 1451 CA LEU A 97 -1.439 6.389 -5.715 1.00 0.00 C ATOM 1452 C LEU A 97 -2.710 5.557 -5.584 1.00 0.00 C ATOM 1453 O LEU A 97 -3.514 5.775 -4.678 1.00 0.00 O ATOM 1454 CB LEU A 97 -0.646 6.340 -4.408 1.00 0.00 C ATOM 1455 CG LEU A 97 -0.778 5.055 -3.591 1.00 0.00 C ATOM 1456 CD1 LEU A 97 -0.331 3.853 -4.410 1.00 0.00 C ATOM 1457 CD2 LEU A 97 0.029 5.155 -2.304 1.00 0.00 C ATOM 0 H LEU A 97 -2.409 8.227 -5.428 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.833 5.967 -6.517 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.408 6.493 -4.640 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.960 7.177 -3.784 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.827 4.921 -3.329 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.432 2.947 -3.812 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.951 3.770 -5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.711 3.980 -4.703 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.077 4.231 -1.735 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.080 5.314 -2.545 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.337 5.991 -1.709 1.00 0.00 H new ATOM 1469 N GLN A 98 -2.882 4.602 -6.492 1.00 0.00 N ATOM 1470 CA GLN A 98 -4.055 3.736 -6.476 1.00 0.00 C ATOM 1471 C GLN A 98 -3.791 2.477 -5.657 1.00 0.00 C ATOM 1472 O GLN A 98 -2.765 1.817 -5.826 1.00 0.00 O ATOM 1473 CB GLN A 98 -4.454 3.356 -7.903 1.00 0.00 C ATOM 1474 CG GLN A 98 -5.923 3.598 -8.209 1.00 0.00 C ATOM 1475 CD GLN A 98 -6.445 2.699 -9.313 1.00 0.00 C ATOM 1476 OE1 GLN A 98 -5.732 1.825 -9.806 1.00 0.00 O ATOM 1477 NE2 GLN A 98 -7.696 2.909 -9.706 1.00 0.00 N ATOM 0 H GLN A 98 -2.225 4.408 -7.247 1.00 0.00 H new ATOM 0 HA GLN A 98 -4.874 4.285 -6.011 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.846 3.927 -8.605 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -4.226 2.303 -8.067 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -6.510 3.435 -7.305 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -6.063 4.640 -8.497 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -8.251 3.645 -9.269 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -8.102 2.334 -10.445 1.00 0.00 H new ATOM 1486 N LEU A 99 -4.723 2.150 -4.768 1.00 0.00 N ATOM 1487 CA LEU A 99 -4.591 0.969 -3.921 1.00 0.00 C ATOM 1488 C LEU A 99 -5.860 0.124 -3.964 1.00 0.00 C ATOM 1489 O LEU A 99 -6.973 0.653 -3.936 1.00 0.00 O ATOM 1490 CB LEU A 99 -4.288 1.383 -2.480 1.00 0.00 C ATOM 1491 CG LEU A 99 -2.956 2.098 -2.253 1.00 0.00 C ATOM 1492 CD1 LEU A 99 -2.970 2.842 -0.926 1.00 0.00 C ATOM 1493 CD2 LEU A 99 -1.803 1.106 -2.298 1.00 0.00 C ATOM 0 H LEU A 99 -5.578 2.685 -4.615 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.764 0.369 -4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.091 2.034 -2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.310 0.491 -1.855 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.814 2.825 -3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.014 3.345 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.772 3.581 -0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.134 2.134 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.863 1.633 -2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.938 0.355 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.781 0.618 -3.272 1.00 0.00 H new ATOM 1505 N LEU A 100 -5.687 -1.191 -4.030 1.00 0.00 N ATOM 1506 CA LEU A 100 -6.819 -2.111 -4.074 1.00 0.00 C ATOM 1507 C LEU A 100 -6.856 -2.989 -2.827 1.00 0.00 C ATOM 1508 O LEU A 100 -5.891 -3.691 -2.522 1.00 0.00 O ATOM 1509 CB LEU A 100 -6.741 -2.986 -5.326 1.00 0.00 C ATOM 1510 CG LEU A 100 -7.911 -3.945 -5.548 1.00 0.00 C ATOM 1511 CD1 LEU A 100 -9.103 -3.206 -6.135 1.00 0.00 C ATOM 1512 CD2 LEU A 100 -7.495 -5.094 -6.455 1.00 0.00 C ATOM 0 H LEU A 100 -4.774 -1.645 -4.054 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.735 -1.521 -4.107 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.661 -2.334 -6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.822 -3.570 -5.280 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.205 -4.358 -4.583 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.926 -3.905 -6.286 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.417 -2.419 -5.449 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.822 -2.764 -7.091 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.340 -5.766 -6.602 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.174 -4.699 -7.419 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.672 -5.641 -5.995 1.00 0.00 H new ATOM 1524 N ILE A 101 -7.975 -2.945 -2.113 1.00 0.00 N ATOM 1525 CA ILE A 101 -8.138 -3.739 -0.901 1.00 0.00 C ATOM 1526 C ILE A 101 -9.066 -4.926 -1.143 1.00 0.00 C ATOM 1527 O ILE A 101 -9.934 -4.880 -2.014 1.00 0.00 O ATOM 1528 CB ILE A 101 -8.698 -2.892 0.256 1.00 0.00 C ATOM 1529 CG1 ILE A 101 -8.417 -1.408 0.013 1.00 0.00 C ATOM 1530 CG2 ILE A 101 -8.097 -3.340 1.580 1.00 0.00 C ATOM 1531 CD1 ILE A 101 -6.943 -1.079 -0.081 1.00 0.00 C ATOM 0 H ILE A 101 -8.782 -2.369 -2.352 1.00 0.00 H new ATOM 0 HA ILE A 101 -7.148 -4.104 -0.627 1.00 0.00 H new ATOM 0 HB ILE A 101 -9.778 -3.036 0.302 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -8.909 -1.100 -0.909 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.860 -0.826 0.821 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.503 -2.732 2.388 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.343 -4.387 1.755 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -7.014 -3.223 1.546 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.819 -0.010 -0.254 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.448 -1.356 0.850 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -6.498 -1.634 -0.907 1.00 0.00 H new ATOM 1543 N GLU A 102 -8.877 -5.986 -0.364 1.00 0.00 N ATOM 1544 CA GLU A 102 -9.698 -7.184 -0.493 1.00 0.00 C ATOM 1545 C GLU A 102 -10.674 -7.303 0.674 1.00 0.00 C ATOM 1546 O GLU A 102 -10.277 -7.250 1.839 1.00 0.00 O ATOM 1547 CB GLU A 102 -8.813 -8.431 -0.561 1.00 0.00 C ATOM 1548 CG GLU A 102 -9.579 -9.704 -0.881 1.00 0.00 C ATOM 1549 CD GLU A 102 -8.847 -10.953 -0.431 1.00 0.00 C ATOM 1550 OE1 GLU A 102 -8.696 -11.142 0.795 1.00 0.00 O ATOM 1551 OE2 GLU A 102 -8.426 -11.742 -1.302 1.00 0.00 O ATOM 0 H GLU A 102 -8.163 -6.040 0.363 1.00 0.00 H new ATOM 0 HA GLU A 102 -10.271 -7.103 -1.417 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -8.044 -8.280 -1.318 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -8.301 -8.555 0.393 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -10.556 -9.667 -0.399 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.755 -9.758 -1.955 1.00 0.00 H new ATOM 1558 N HIS A 103 -11.954 -7.464 0.353 1.00 0.00 N ATOM 1559 CA HIS A 103 -12.988 -7.590 1.374 1.00 0.00 C ATOM 1560 C HIS A 103 -13.587 -8.994 1.369 1.00 0.00 C ATOM 1561 O HIS A 103 -14.187 -9.420 0.383 1.00 0.00 O ATOM 1562 CB HIS A 103 -14.088 -6.553 1.147 1.00 0.00 C ATOM 1563 CG HIS A 103 -14.004 -5.378 2.072 1.00 0.00 C ATOM 1564 ND1 HIS A 103 -13.634 -5.488 3.396 1.00 0.00 N ATOM 1565 CD2 HIS A 103 -14.243 -4.063 1.857 1.00 0.00 C ATOM 1566 CE1 HIS A 103 -13.650 -4.291 3.956 1.00 0.00 C ATOM 1567 NE2 HIS A 103 -14.016 -3.409 3.043 1.00 0.00 N ATOM 0 H HIS A 103 -12.300 -7.510 -0.606 1.00 0.00 H new ATOM 0 HA HIS A 103 -12.528 -7.413 2.346 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -14.035 -6.199 0.117 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -15.059 -7.033 1.270 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -14.554 -3.612 0.926 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -13.406 -4.071 4.985 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -14.114 -2.405 3.194 1.00 0.00 H new ATOM 1576 N ASP A 104 -13.419 -9.707 2.478 1.00 0.00 N ATOM 1577 CA ASP A 104 -13.943 -11.062 2.602 1.00 0.00 C ATOM 1578 C ASP A 104 -15.018 -11.132 3.681 1.00 0.00 C ATOM 1579 O ASP A 104 -15.015 -10.367 4.646 1.00 0.00 O ATOM 1580 CB ASP A 104 -12.813 -12.041 2.925 1.00 0.00 C ATOM 1581 CG ASP A 104 -11.483 -11.602 2.345 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -11.488 -10.784 1.402 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -10.436 -12.078 2.833 1.00 0.00 O ATOM 0 H ASP A 104 -12.924 -9.369 3.303 1.00 0.00 H new ATOM 0 HA ASP A 104 -14.392 -11.340 1.649 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -12.720 -12.139 4.007 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -13.068 -13.027 2.536 1.00 0.00 H new ATOM 1588 N PRO A 105 -15.963 -12.070 3.516 1.00 0.00 N ATOM 1589 CA PRO A 105 -17.062 -12.262 4.466 1.00 0.00 C ATOM 1590 C PRO A 105 -16.586 -12.836 5.796 1.00 0.00 C ATOM 1591 O PRO A 105 -16.960 -12.349 6.863 1.00 0.00 O ATOM 1592 CB PRO A 105 -17.979 -13.258 3.752 1.00 0.00 C ATOM 1593 CG PRO A 105 -17.081 -14.000 2.823 1.00 0.00 C ATOM 1594 CD PRO A 105 -16.029 -13.016 2.390 1.00 0.00 C ATOM 0 HA PRO A 105 -17.549 -11.320 4.721 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -18.460 -13.932 4.461 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -18.774 -12.746 3.210 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -16.631 -14.860 3.319 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.635 -14.381 1.965 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -15.069 -13.503 2.218 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -16.304 -12.516 1.461 1.00 0.00 H new ATOM 1602 N VAL A 106 -15.758 -13.874 5.725 1.00 0.00 N ATOM 1603 CA VAL A 106 -15.229 -14.513 6.924 1.00 0.00 C ATOM 1604 C VAL A 106 -15.013 -13.496 8.039 1.00 0.00 C ATOM 1605 O VAL A 106 -14.619 -12.354 7.804 1.00 0.00 O ATOM 1606 CB VAL A 106 -13.899 -15.233 6.636 1.00 0.00 C ATOM 1607 CG1 VAL A 106 -13.317 -14.769 5.309 1.00 0.00 C ATOM 1608 CG2 VAL A 106 -12.912 -15.002 7.770 1.00 0.00 C ATOM 0 H VAL A 106 -15.439 -14.290 4.850 1.00 0.00 H new ATOM 0 HA VAL A 106 -15.969 -15.247 7.244 1.00 0.00 H new ATOM 0 HB VAL A 106 -14.093 -16.303 6.566 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -12.377 -15.289 5.122 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -14.020 -14.991 4.506 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -13.136 -13.695 5.347 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -11.978 -15.518 7.550 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -12.721 -13.934 7.874 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -13.329 -15.388 8.700 1.00 0.00 H new ATOM 1618 N PRO A 107 -15.276 -13.919 9.285 1.00 0.00 N ATOM 1619 CA PRO A 107 -15.116 -13.061 10.462 1.00 0.00 C ATOM 1620 C PRO A 107 -13.652 -12.762 10.768 1.00 0.00 C ATOM 1621 O PRO A 107 -12.758 -13.189 10.038 1.00 0.00 O ATOM 1622 CB PRO A 107 -15.740 -13.886 11.590 1.00 0.00 C ATOM 1623 CG PRO A 107 -15.618 -15.300 11.137 1.00 0.00 C ATOM 1624 CD PRO A 107 -15.749 -15.268 9.639 1.00 0.00 C ATOM 0 HA PRO A 107 -15.581 -12.085 10.321 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -15.218 -13.726 12.533 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -16.782 -13.611 11.752 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -14.659 -15.724 11.436 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -16.395 -15.921 11.583 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -15.145 -16.043 9.166 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -16.779 -15.429 9.322 1.00 0.00 H new ATOM 1632 N GLN A 108 -13.416 -12.027 11.850 1.00 0.00 N ATOM 1633 CA GLN A 108 -12.060 -11.672 12.250 1.00 0.00 C ATOM 1634 C GLN A 108 -11.246 -12.919 12.583 1.00 0.00 C ATOM 1635 O GLN A 108 -11.685 -13.770 13.357 1.00 0.00 O ATOM 1636 CB GLN A 108 -12.091 -10.732 13.457 1.00 0.00 C ATOM 1637 CG GLN A 108 -10.805 -9.945 13.648 1.00 0.00 C ATOM 1638 CD GLN A 108 -10.674 -8.794 12.670 1.00 0.00 C ATOM 1639 OE1 GLN A 108 -11.510 -7.891 12.641 1.00 0.00 O ATOM 1640 NE2 GLN A 108 -9.621 -8.821 11.861 1.00 0.00 N ATOM 0 H GLN A 108 -14.146 -11.666 12.465 1.00 0.00 H new ATOM 0 HA GLN A 108 -11.583 -11.162 11.413 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -12.921 -10.034 13.342 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -12.287 -11.315 14.357 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -10.769 -9.557 14.666 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -9.953 -10.615 13.531 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.953 -9.589 11.919 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.481 -8.073 11.181 1.00 0.00 H new ATOM 1649 N ARG A 109 -10.060 -13.020 11.993 1.00 0.00 N ATOM 1650 CA ARG A 109 -9.186 -14.163 12.226 1.00 0.00 C ATOM 1651 C ARG A 109 -8.868 -14.311 13.711 1.00 0.00 C ATOM 1652 O ARG A 109 -8.002 -13.616 14.244 1.00 0.00 O ATOM 1653 CB ARG A 109 -7.889 -14.012 11.428 1.00 0.00 C ATOM 1654 CG ARG A 109 -8.049 -14.302 9.945 1.00 0.00 C ATOM 1655 CD ARG A 109 -6.817 -14.987 9.375 1.00 0.00 C ATOM 1656 NE ARG A 109 -6.536 -14.560 8.007 1.00 0.00 N ATOM 1657 CZ ARG A 109 -7.175 -15.035 6.943 1.00 0.00 C ATOM 1658 NH1 ARG A 109 -8.126 -15.947 7.090 1.00 0.00 N ATOM 1659 NH2 ARG A 109 -6.863 -14.597 5.730 1.00 0.00 N ATOM 0 H ARG A 109 -9.682 -12.324 11.350 1.00 0.00 H new ATOM 0 HA ARG A 109 -9.707 -15.060 11.893 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -7.512 -12.997 11.552 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.137 -14.684 11.842 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -8.923 -14.934 9.789 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -8.230 -13.371 9.408 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -5.956 -14.769 10.007 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.961 -16.067 9.395 1.00 0.00 H new ATOM 0 HE ARG A 109 -5.810 -13.859 7.860 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -8.369 -16.285 8.021 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -8.615 -16.310 6.272 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -6.132 -13.895 5.614 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -7.354 -14.962 4.914 1.00 0.00 H new ATOM 1673 N LEU A 110 -9.574 -15.220 14.374 1.00 0.00 N ATOM 1674 CA LEU A 110 -9.368 -15.460 15.798 1.00 0.00 C ATOM 1675 C LEU A 110 -9.812 -16.867 16.183 1.00 0.00 C ATOM 1676 O LEU A 110 -10.888 -17.319 15.792 1.00 0.00 O ATOM 1677 CB LEU A 110 -10.135 -14.427 16.625 1.00 0.00 C ATOM 1678 CG LEU A 110 -9.517 -14.054 17.973 1.00 0.00 C ATOM 1679 CD1 LEU A 110 -9.790 -12.594 18.300 1.00 0.00 C ATOM 1680 CD2 LEU A 110 -10.054 -14.957 19.074 1.00 0.00 C ATOM 0 H LEU A 110 -10.294 -15.803 13.948 1.00 0.00 H new ATOM 0 HA LEU A 110 -8.302 -15.365 16.007 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -10.237 -13.519 16.031 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -11.141 -14.807 16.802 1.00 0.00 H new ATOM 0 HG LEU A 110 -8.438 -14.195 17.907 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -9.343 -12.347 19.263 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.357 -11.961 17.526 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -10.866 -12.427 18.346 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.603 -14.677 20.026 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -11.137 -14.847 19.139 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -9.807 -15.994 18.847 1.00 0.00 H new ATOM 1692 N ASP A 111 -8.976 -17.555 16.954 1.00 0.00 N ATOM 1693 CA ASP A 111 -9.283 -18.911 17.395 1.00 0.00 C ATOM 1694 C ASP A 111 -9.716 -18.921 18.858 1.00 0.00 C ATOM 1695 O ASP A 111 -8.881 -18.893 19.762 1.00 0.00 O ATOM 1696 CB ASP A 111 -8.069 -19.820 17.203 1.00 0.00 C ATOM 1697 CG ASP A 111 -7.261 -19.456 15.973 1.00 0.00 C ATOM 1698 OD1 ASP A 111 -7.587 -19.960 14.879 1.00 0.00 O ATOM 1699 OD2 ASP A 111 -6.302 -18.666 16.105 1.00 0.00 O ATOM 0 H ASP A 111 -8.081 -17.196 17.286 1.00 0.00 H new ATOM 0 HA ASP A 111 -10.107 -19.286 16.788 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -7.431 -19.759 18.084 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -8.403 -20.854 17.122 1.00 0.00 H new ATOM 1704 N GLN A 112 -11.025 -18.960 19.083 1.00 0.00 N ATOM 1705 CA GLN A 112 -11.568 -18.971 20.436 1.00 0.00 C ATOM 1706 C GLN A 112 -11.057 -20.177 21.217 1.00 0.00 C ATOM 1707 O GLN A 112 -11.053 -21.300 20.713 1.00 0.00 O ATOM 1708 CB GLN A 112 -13.097 -18.986 20.395 1.00 0.00 C ATOM 1709 CG GLN A 112 -13.695 -17.857 19.572 1.00 0.00 C ATOM 1710 CD GLN A 112 -14.183 -16.705 20.428 1.00 0.00 C ATOM 1711 OE1 GLN A 112 -13.810 -16.583 21.595 1.00 0.00 O ATOM 1712 NE2 GLN A 112 -15.022 -15.853 19.852 1.00 0.00 N ATOM 0 H GLN A 112 -11.729 -18.985 18.346 1.00 0.00 H new ATOM 0 HA GLN A 112 -11.234 -18.065 20.942 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -13.432 -19.939 19.986 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -13.480 -18.924 21.414 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -12.948 -17.490 18.868 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -14.526 -18.244 18.982 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -15.305 -15.993 18.882 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -15.384 -15.059 20.379 1.00 0.00 H new ATOM 1721 N SER A 113 -10.625 -19.937 22.451 1.00 0.00 N ATOM 1722 CA SER A 113 -10.107 -21.003 23.301 1.00 0.00 C ATOM 1723 C SER A 113 -10.911 -21.107 24.593 1.00 0.00 C ATOM 1724 O SER A 113 -11.146 -22.200 25.105 1.00 0.00 O ATOM 1725 CB SER A 113 -8.632 -20.756 23.623 1.00 0.00 C ATOM 1726 OG SER A 113 -8.211 -19.489 23.148 1.00 0.00 O ATOM 0 H SER A 113 -10.623 -19.014 22.885 1.00 0.00 H new ATOM 0 HA SER A 113 -10.201 -21.944 22.759 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.477 -20.814 24.700 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.022 -21.538 23.171 1.00 0.00 H new ATOM 0 HG SER A 113 -7.265 -19.355 23.368 1.00 0.00 H new ATOM 1732 N GLY A 114 -11.331 -19.958 25.115 1.00 0.00 N ATOM 1733 CA GLY A 114 -12.104 -19.940 26.343 1.00 0.00 C ATOM 1734 C GLY A 114 -11.814 -18.719 27.193 1.00 0.00 C ATOM 1735 O GLY A 114 -10.735 -18.130 27.124 1.00 0.00 O ATOM 0 H GLY A 114 -11.150 -19.040 24.709 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -13.166 -19.966 26.100 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -11.887 -20.840 26.919 1.00 0.00 H new ATOM 1739 N PRO A 115 -12.795 -18.319 28.016 1.00 0.00 N ATOM 1740 CA PRO A 115 -12.664 -17.156 28.898 1.00 0.00 C ATOM 1741 C PRO A 115 -11.676 -17.397 30.033 1.00 0.00 C ATOM 1742 O PRO A 115 -10.775 -16.591 30.267 1.00 0.00 O ATOM 1743 CB PRO A 115 -14.079 -16.968 29.450 1.00 0.00 C ATOM 1744 CG PRO A 115 -14.700 -18.320 29.367 1.00 0.00 C ATOM 1745 CD PRO A 115 -14.108 -18.974 28.150 1.00 0.00 C ATOM 0 HA PRO A 115 -12.279 -16.284 28.368 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -14.058 -16.604 30.477 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -14.639 -16.238 28.865 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -14.489 -18.902 30.264 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -15.784 -18.247 29.282 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -14.008 -20.051 28.281 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -14.728 -18.816 27.267 1.00 0.00 H new ATOM 1753 N SER A 116 -11.851 -18.511 30.737 1.00 0.00 N ATOM 1754 CA SER A 116 -10.976 -18.857 31.851 1.00 0.00 C ATOM 1755 C SER A 116 -9.514 -18.605 31.492 1.00 0.00 C ATOM 1756 O SER A 116 -8.996 -19.163 30.525 1.00 0.00 O ATOM 1757 CB SER A 116 -11.171 -20.322 32.245 1.00 0.00 C ATOM 1758 OG SER A 116 -11.442 -21.124 31.108 1.00 0.00 O ATOM 0 H SER A 116 -12.591 -19.189 30.556 1.00 0.00 H new ATOM 0 HA SER A 116 -11.239 -18.223 32.698 1.00 0.00 H new ATOM 0 HB2 SER A 116 -10.276 -20.689 32.748 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.993 -20.404 32.956 1.00 0.00 H new ATOM 0 HG SER A 116 -11.561 -22.056 31.386 1.00 0.00 H new ATOM 1764 N SER A 117 -8.856 -17.761 32.280 1.00 0.00 N ATOM 1765 CA SER A 117 -7.455 -17.431 32.044 1.00 0.00 C ATOM 1766 C SER A 117 -6.730 -17.168 33.361 1.00 0.00 C ATOM 1767 O SER A 117 -7.292 -17.354 34.439 1.00 0.00 O ATOM 1768 CB SER A 117 -7.343 -16.207 31.134 1.00 0.00 C ATOM 1769 OG SER A 117 -7.861 -16.482 29.843 1.00 0.00 O ATOM 0 H SER A 117 -9.270 -17.294 33.087 1.00 0.00 H new ATOM 0 HA SER A 117 -6.984 -18.283 31.553 1.00 0.00 H new ATOM 0 HB2 SER A 117 -7.884 -15.371 31.576 1.00 0.00 H new ATOM 0 HB3 SER A 117 -6.299 -15.904 31.053 1.00 0.00 H new ATOM 0 HG SER A 117 -8.838 -16.538 29.888 1.00 0.00 H new ATOM 1775 N GLY A 118 -5.477 -16.732 33.263 1.00 0.00 N ATOM 1776 CA GLY A 118 -4.695 -16.450 34.452 1.00 0.00 C ATOM 1777 C GLY A 118 -3.538 -17.414 34.627 1.00 0.00 C ATOM 1778 O GLY A 118 -2.375 -17.023 34.530 1.00 0.00 O ATOM 0 H GLY A 118 -4.990 -16.569 32.381 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -4.310 -15.432 34.397 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.341 -16.500 35.328 1.00 0.00 H new TER 1782 GLY A 118